(5R,7R)-Methyl-3-[(1R)-(1-naphthyl)ethyl]-1,2,3,4,5,6,7,8-octahydro-5-[2-xi.-(1,3-dioxolan-2-yl)-1-butyl]azonino[6,7b]indole-7-carboxylate

SpectraBase Compound ID	LT39YpWhVn6
InChI	InChI=1S/C35H42N2O4/c1-4-25(35-40-18-19-41-35)20-24-21-31(34(38)39-3)33-30(29-13-7-8-15-32(29)36-33)16-17-37(22-24)23(2)27-14-9-11-26-10-5-6-12-28(26)27/h5-15,23-25,31,35-36H,4,16-22H2,1-3H3/t23-,24-,25?,31-/m1/s1
InChIKey	HVUUNYDHCPPMSP-PGJABVETSA-N Google Search
Mol Weight	554.7 g/mol
Molecular Formula	C35H42N2O4
Exact Mass	554.314458 g/mol

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SpectraBase Spectrum ID	7vhjs1xYVCe
Name	(5R,7R)-Methyl-3-[(1R)-(1-naphthyl)ethyl]-1,2,3,4,5,6,7,8-octahydro-5-[2-xi.-(1,3-dioxolan-2-yl)-1-butyl]azonino[6,7b]indole-7-carboxylate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C35H42N2O4
InChI	InChI=1S/C35H42N2O4/c1-4-25(35-40-18-19-41-35)20-24-21-31(34(38)39-3)33-30(29-13-7-8-15-32(29)36-33)16-17-37(22-24)23(2)27-14-9-11-26-10-5-6-12-28(26)27/h5-15,23-25,31,35-36H,4,16-22H2,1-3H3/t23-,24-,25?,31-/m1/s1
InChIKey	HVUUNYDHCPPMSP-PGJABVETSA-N
Molecular Weight	554.731 g/mol
SMILES	[nH]1c2ccccc2c2c1[C@@](C[C@](CN(CC2)[C@@](c1c2c(cccc2)ccc1)(C)[H])(CC(C1OCCO1)CC)[H])(C(=O)OC)[H]
SPLASH	splash10-0a4i-2921000000-d42a58d04d92135e7b01
Source of Spectrum	KC-57-2089-15
Synonyms	(5R,7R)-5-[2-(1,3-dioxolan-2-yl)butyl]-3-[(1R)-1-(1-naphthalenyl)ethyl]-2,4,5,6,7,8-hexahydro-1H-azonino[5,4-b]indole-7-carboxylic acid methyl ester Methyl (5R,7R)-5-[2-(1,3-dioxolan-2-yl)butyl]-3-[(1R)-1-(1-naphthyl)ethyl]-2,4,5,6,7,8-hexahydro-1H-azonino[5,4-b]indole-7-carboxylate Methyl (5R,7R)-5-[2-(1,3-dioxolan-2-yl)butyl]-3-[(1R)-1-naphthalen-1-ylethyl]-2,4,5,6,7,8-hexahydro-1H-azonino[5,4-b]indole-7-carboxylate
Wiley ID	1623293