3-(4-Methylphenyl)-3-[[1-oxo-3-[1-(phenylmethyl)-3-indolyl]propyl]amino]propanoic acid ethyl ester

SpectraBase Compound ID	IIKxaUmv6KR
InChI	InChI=1S/C30H32N2O3/c1-3-35-30(34)19-27(24-15-13-22(2)14-16-24)31-29(33)18-17-25-21-32(20-23-9-5-4-6-10-23)28-12-8-7-11-26(25)28/h4-16,21,27H,3,17-20H2,1-2H3,(H,31,33)
InChIKey	WQTWOWCMCPEDPY-UHFFFAOYSA-N Google Search
Mol Weight	468.6 g/mol
Molecular Formula	C30H32N2O3
Exact Mass	468.241293 g/mol

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SpectraBase Spectrum ID	3eJYitlcgbu
Name	3-(4-Methylphenyl)-3-[[1-oxo-3-[1-(phenylmethyl)-3-indolyl]propyl]amino]propanoic acid ethyl ester
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	468.241292895 u
Formula	C30H32N2O3
InChI	InChI=1S/C30H32N2O3/c1-3-35-30(34)19-27(24-15-13-22(2)14-16-24)31-29(33)18-17-25-21-32(20-23-9-5-4-6-10-23)28-12-8-7-11-26(25)28/h4-16,21,27H,3,17-20H2,1-2H3,(H,31,33)
InChIKey	WQTWOWCMCPEDPY-UHFFFAOYSA-N
Molecular Weight	468.597 g/mol
SMILES	C1=CC=C(CN2C=C(CCC(NC(CC(=O)OCC)C=3C=CC(=CC3)C)=O)C3=C2C=CC=C3)C=C1