17-(2-methoxyethanoyl)-13-methyl-11-(4-piperidin-1-ylphenyl)-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one

Systemtic Name: 17-(2-methoxyethanoyl)-13-methyl-11-(4-piperidin-1-ylphenyl)-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one Openeye Name: 17-(2-methoxyacetyl)-13-methyl-11-[4-(1-piperidyl)phenyl]-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one CAS Name: 17-(2-methoxy-1-oxoethyl)-13-methyl-11-[4-(1-piperidinyl)phenyl]-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one IUPAC Name: 17-(2-methoxyacetyl)-13-methyl-11-(4-piperidin-1-ylphenyl)-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one Traditional Name: 17-(2-methoxyacetyl)-13-methyl-11-(4-piperidinophenyl)-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one Formula: C35H43NO3 MolecularWeight: 525.72082

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC1(CCC2C1(CC(C3=C4CCC(=O)C=C4CCC23)C5=CC=C(C=C5)N6CCCCC6)C)C(=O)COC

Isomeric SMILES

CC#CC1(CCC2C1(CC(C3=C4CCC(=O)C=C4CCC23)C5=CC=C(C=C5)N6CCCCC6)C)C(=O)COC

InChI

InChI=1S/C35H43NO3/c1-4-17-35(32(38)23-39-3)18-16-31-29-14-10-25-21-27(37)13-15-28(25)33(29)30(22-34(31,35)2)24-8-11-26(12-9-24)36-19-6-5-7-20-36/h8-9,11-12,21,29-31H,5-7,10,13-16,18-20,22-23H2,1-3H3