3-methoxy-10,13-dimethyl-9,17-bis(oxidanyl)-1,2,7,8,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-7-carbonitrile

Systemtic Name: 3-methoxy-10,13-dimethyl-9,17-bis(oxidanyl)-1,2,7,8,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-7-carbonitrile Openeye Name: 9,17-dihydroxy-3-methoxy-10,13-dimethyl-1,2,7,8,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-7-carbonitrile CAS Name: 9,17-dihydroxy-3-methoxy-10,13-dimethyl-1,2,7,8,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-7-carbonitrile IUPAC Name: 9,17-dihydroxy-3-methoxy-10,13-dimethyl-1,2,7,8,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-7-carbonitrile Traditional Name: 9,17-dihydroxy-3-methoxy-10,13-dimethyl-1,2,7,8,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-7-carbonitrile Formula: C21H29NO3 MolecularWeight: 343.45986

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC3(C(C1CCC2O)C(C=C4C3(CCC(=C4)OC)C)C#N)O

Isomeric SMILES

CC12CCC3(C(C1CCC2O)C(C=C4C3(CCC(=C4)OC)C)C#N)O

InChI

InChI=1S/C21H29NO3/c1-19-8-9-21(24)18(16(19)4-5-17(19)23)13(12-22)10-14-11-15(25-3)6-7-20(14,21)2/h10-11,13,16-18,23-24H,4-9H2,1-3H3