3-[3-(3-azanyl-3-oxidanylidene-propoxy)-5-[3-(10,13-dimethyl-17-oxidanyl-3-oxidanylidene-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11-yl)propyl]phenoxy]propanamide

Systemtic Name: 3-[3-(3-azanyl-3-oxidanylidene-propoxy)-5-[3-(10,13-dimethyl-17-oxidanyl-3-oxidanylidene-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11-yl)propyl]phenoxy]propanamide Openeye Name: 3-[3-(3-amino-3-oxo-propoxy)-5-[3-(17-hydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11-yl)propyl]phenoxy]propanamide CAS Name: 3-[3-(3-amino-3-oxopropoxy)-5-[3-(17-hydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11-yl)propyl]phenoxy]propanamide IUPAC Name: 3-[3-(3-amino-3-oxopropoxy)-5-[3-(17-hydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11-yl)propyl]phenoxy]propanamide Traditional Name: 3-[3-(3-amino-3-keto-propoxy)-5-[3-(17-hydroxy-3-keto-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11-yl)propyl]phenoxy]propionamide Formula: C34H50N2O6 MolecularWeight: 582.7706

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC(=O)CC1CCC3C2C(CC4(C3CCC4O)C)CCCC5=CC(=CC(=C5)OCCC(=O)N)OCCC(=O)N

Isomeric SMILES

CC12CCC(=O)CC1CCC3C2C(CC4(C3CCC4O)C)CCCC5=CC(=CC(=C5)OCCC(=O)N)OCCC(=O)N

InChI

InChI=1S/C34H50N2O6/c1-33-13-10-24(37)18-23(33)6-7-27-28-8-9-29(38)34(28,2)20-22(32(27)33)5-3-4-21-16-25(41-14-11-30(35)39)19-26(17-21)42-15-12-31(36)40/h16-17,19,22-23,27-29,32,38H,3-15,18,20H2,1-2H3,(H2,35,39)(H2,36,40)