17-(5-imidazol-1-yl-5-oxidanylidene-pentan-2-yl)-10,13-dimethyl-1,2,4,5,6,8,9,11,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3,7,12-trione

Systemtic Name: 17-(5-imidazol-1-yl-5-oxidanylidene-pentan-2-yl)-10,13-dimethyl-1,2,4,5,6,8,9,11,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3,7,12-trione Openeye Name: 17-(4-imidazol-1-yl-1-methyl-4-oxo-butyl)-10,13-dimethyl-1,2,4,5,6,8,9,11,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3,7,12-trione CAS Name: 17-[5-(1-imidazolyl)-5-oxopentan-2-yl]-10,13-dimethyl-1,2,4,5,6,8,9,11,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3,7,12-trione IUPAC Name: 17-(5-imidazol-1-yl-5-oxopentan-2-yl)-10,13-dimethyl-1,2,4,5,6,8,9,11,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3,7,12-trione Traditional Name: 17-(4-imidazol-1-yl-4-keto-1-methyl-butyl)-10,13-dimethyl-1,2,4,5,6,8,9,11,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3,7,12-trione Formula: C27H36N2O4 MolecularWeight: 452.58574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)N1C=CN=C1)C2CCC3C2(C(=O)CC4C3C(=O)CC5C4(CCC(=O)C5)C)C

Isomeric SMILES

CC(CCC(=O)N1C=CN=C1)C2CCC3C2(C(=O)CC4C3C(=O)CC5C4(CCC(=O)C5)C)C

InChI

InChI=1S/C27H36N2O4/c1-16(4-7-24(33)29-11-10-28-15-29)19-5-6-20-25-21(14-23(32)27(19,20)3)26(2)9-8-18(30)12-17(26)13-22(25)31/h10-11,15-17,19-21,25H,4-9,12-14H2,1-3H3