[17-(2-chloranylethanoyl)-10,13-dimethyl-11-oxidanyl-3-oxidanylidene-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] propanoate

Systemtic Name: [17-(2-chloranylethanoyl)-10,13-dimethyl-11-oxidanyl-3-oxidanylidene-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] propanoate Openeye Name: [17-(2-chloroacetyl)-11-hydroxy-10,13-dimethyl-3-oxo-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] propanoate CAS Name: propanoic acid [17-(2-chloro-1-oxoethyl)-11-hydroxy-10,13-dimethyl-3-oxo-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] ester IUPAC Name: [17-(2-chloroacetyl)-11-hydroxy-10,13-dimethyl-3-oxo-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] propanoate Traditional Name: propionic acid [17-(2-chloroacetyl)-11-hydroxy-3-keto-10,13-dimethyl-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] ester Formula: C24H35ClO5 MolecularWeight: 438.9847

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1(CCC2C1(CC(C3C2CCC4C3(CCC(=O)C4)C)O)C)C(=O)CCl

Isomeric SMILES

CCC(=O)OC1(CCC2C1(CC(C3C2CCC4C3(CCC(=O)C4)C)O)C)C(=O)CCl

InChI

InChI=1S/C24H35ClO5/c1-4-20(29)30-24(19(28)13-25)10-8-17-16-6-5-14-11-15(26)7-9-22(14,2)21(16)18(27)12-23(17,24)3/h14,16-18,21,27H,4-13H2,1-3H3