4-chloranyl-2-[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]benzoic acid

Systemtic Name: 4-chloranyl-2-[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]benzoic acid Openeye Name: 4-chloro-2-[17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]benzoic acid CAS Name: 4-chloro-2-[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]benzoic acid IUPAC Name: 4-chloro-2-[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]benzoic acid Traditional Name: 4-chloro-2-[17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]benzoic acid Formula: C34H49ClO2 MolecularWeight: 525.20466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)C5=C(C=CC(=C5)Cl)C(=O)O)C)C

Isomeric SMILES

CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)C5=C(C=CC(=C5)Cl)C(=O)O)C)C

InChI

InChI=1S/C34H49ClO2/c1-21(2)7-6-8-22(3)29-13-14-30-27-11-9-24-19-23(28-20-25(35)10-12-26(28)32(36)37)15-17-33(24,4)31(27)16-18-34(29,30)5/h9-10,12,20-23,27,29-31H,6-8,11,13-19H2,1-5H3,(H,36,37)