SpectraBase Spectrum ID |
IsZqrGGVYnB |
Name |
22H-Biline-1-carbonitrile, 1,2,3,23-tetrahydro-1,2,2,7,8,12,13,17,18-nonamethyl- |
CAS Registry Number |
112026-06-9 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C29H35N5 |
InChI |
InChI=1S/C29H35N5/c1-16-14-31-23(17(16)2)11-25-20(5)21(6)27(33-25)12-26-19(4)18(3)24(32-26)10-22-13-28(7,8)29(9,15-30)34-22/h10-12,14,32-33H,13H2,1-9H3/b23-11-,24-10-,26-12- |
InChIKey |
AFROXCITQKNXKR-SCEPZEOJSA-N |
Molecular Weight |
453.634 g/mol |
SMILES |
N1\C(=C/c2c(c(c([nH]2)\C=C\2N=CC(=C2C)C)C)C)C(=C(C)\C1=C/C1=NC(C#N)(C)C(C1)(C)C)C |
SPLASH |
splash10-0fb9-0000900000-d0cb16700da676376c3e |
Source of Spectrum |
H-70-408-22 |
Synonyms |
17,18,19,23-Tetrahydro-2,3,7,8,12,13,18,18,19-nonamethyl-22H-biline-19-carbonitrile
5-{(Z)-[(5Z)-5-({5-[(Z)-(3,4-Dimethyl-2H-pyrrol-2-ylidene)methyl]-3,4-dimethyl-1H-pyrrol-2-yl}methylene)-3,4-dimethyl-1,5-dihydro-2H-pyrrol-2-ylidene]methyl}-2,3,3-trimethyl-3,4-dihydro-2H-pyrrole-2-carbonitrile |
Wiley ID |
1388552 |