2-(3-methoxy-13-methyl-6,7,8,9,11,12-hexahydrocyclopenta[a]phenanthren-17-yl)ethanoate

Systemtic Name: 2-(3-methoxy-13-methyl-6,7,8,9,11,12-hexahydrocyclopenta[a]phenanthren-17-yl)ethanoate Openeye Name: 2-(3-methoxy-13-methyl-6,7,8,9,11,12-hexahydrocyclopenta[a]phenanthren-17-yl)acetate CAS Name: 2-(3-methoxy-13-methyl-6,7,8,9,11,12-hexahydrocyclopenta[a]phenanthren-17-yl)acetate IUPAC Name: 2-(3-methoxy-13-methyl-6,7,8,9,11,12-hexahydrocyclopenta[a]phenanthren-17-yl)acetate Traditional Name: 2-(3-methoxy-13-methyl-6,7,8,9,11,12-hexahydrocyclopenta[a]phenanthren-17-yl)acetate Formula: C21H23O3- MolecularWeight: 323.40552

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC3C(C1=CC=C2CC(=O)[O-])CCC4=C3C=CC(=C4)OC

Isomeric SMILES

CC12CCC3C(C1=CC=C2CC(=O)[O-])CCC4=C3C=CC(=C4)OC

InChI

InChI=1S/C21H24O3/c1-21-10-9-17-16-7-5-15(24-2)11-13(16)3-6-18(17)19(21)8-4-14(21)12-20(22)23/h4-5,7-8,11,17-18H,3,6,9-10,12H2,1-2H3,(H,22,23)/p-1