10,13-dimethyl-1,3,11-tris(oxidanyl)-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-17-carbonitrile

Systemtic Name: 10,13-dimethyl-1,3,11-tris(oxidanyl)-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-17-carbonitrile Openeye Name: 1,3,11-trihydroxy-10,13-dimethyl-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-17-carbonitrile CAS Name: 1,3,11-trihydroxy-10,13-dimethyl-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-17-carbonitrile IUPAC Name: 1,3,11-trihydroxy-10,13-dimethyl-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-17-carbonitrile Traditional Name: 1,3,11-trihydroxy-10,13-dimethyl-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-17-carbonitrile Formula: C20H27NO3 MolecularWeight: 329.43328

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC(C3C(C1CCC2C#N)CC=C4C3(C(CC(=C4)O)O)C)O

Isomeric SMILES

CC12CC(C3C(C1CCC2C#N)CC=C4C3(C(CC(=C4)O)O)C)O

InChI

InChI=1S/C20H27NO3/c1-19-9-16(23)18-14(15(19)6-4-12(19)10-21)5-3-11-7-13(22)8-17(24)20(11,18)2/h3,7,12,14-18,22-24H,4-6,8-9H2,1-2H3