methyl 17-[tert-butyl(tert-butylcarbamoyl)carbamoyl]-10,13-dimethyl-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3-carboxylate

Systemtic Name: methyl 17-[tert-butyl(tert-butylcarbamoyl)carbamoyl]-10,13-dimethyl-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3-carboxylate Openeye Name: methyl 17-[tert-butyl(tert-butylcarbamoyl)carbamoyl]-10,13-dimethyl-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3-carboxylate CAS Name: 17-[[tert-butyl-[(tert-butylamino)-oxomethyl]amino]-oxomethyl]-10,13-dimethyl-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3-carboxylic acid methyl ester IUPAC Name: methyl 17-[tert-butyl(tert-butylcarbamoyl)carbamoyl]-10,13-dimethyl-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3-carboxylate Traditional Name: 17-[tert-butyl(tert-butylcarbamoyl)carbamoyl]-10,13-dimethyl-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3-carboxylic acid methyl ester Formula: C31H48N2O4 MolecularWeight: 512.72382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC12CCC3C(C1CCC2C(=O)N(C(=O)NC(C)(C)C)C(C)(C)C)CC=C4C3(CCC(=C4)C(=O)OC)C

Isomeric SMILES

CC12CCC3C(C1CCC2C(=O)N(C(=O)NC(C)(C)C)C(C)(C)C)CC=C4C3(CCC(=C4)C(=O)OC)C

InChI

InChI=1S/C31H48N2O4/c1-28(2,3)32-27(36)33(29(4,5)6)25(34)24-13-12-22-21-11-10-20-18-19(26(35)37-9)14-16-30(20,7)23(21)15-17-31(22,24)8/h10,18,21-24H,11-17H2,1-9H3,(H,32,36)