8-tert-butyl-9a,11a-dimethyl-7-oxidanylidene-2,3,3a,3b,4,5,9,9b,10,11-decahydro-1H-cyclopenta[i]phenanthridine-1,8-dicarboxylic acid

Systemtic Name: 8-tert-butyl-9a,11a-dimethyl-7-oxidanylidene-2,3,3a,3b,4,5,9,9b,10,11-decahydro-1H-cyclopenta[i]phenanthridine-1,8-dicarboxylic acid Openeye Name: 8-tert-butyl-9a,11a-dimethyl-7-oxo-2,3,3a,3b,4,5,9,9b,10,11-decahydro-1H-cyclopenta[i]phenanthridine-1,8-dicarboxylic acid CAS Name: 8-tert-butyl-9a,11a-dimethyl-7-oxo-2,3,3a,3b,4,5,9,9b,10,11-decahydro-1H-cyclopenta[i]phenanthridine-1,8-dicarboxylic acid IUPAC Name: 8-tert-butyl-9a,11a-dimethyl-7-oxo-2,3,3a,3b,4,5,9,9b,10,11-decahydro-1H-cyclopenta[i]phenanthridine-1,8-dicarboxylic acid Traditional Name: 8-tert-butyl-7-keto-9a,11a-dimethyl-2,3,3a,3b,4,5,9,9b,10,11-decahydro-1H-cyclopenta[i]phenanthridine-1,8-dicarboxylic acid Formula: C24H35NO5 MolecularWeight: 417.5384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC12CCC3C(C1CCC2C(=O)O)CNC4=CC(=O)C(CC34C)(C(=O)O)C(C)(C)C

Isomeric SMILES

CC12CCC3C(C1CCC2C(=O)O)CNC4=CC(=O)C(CC34C)(C(=O)O)C(C)(C)C

InChI

InChI=1S/C24H35NO5/c1-21(2,3)24(20(29)30)12-23(5)15-8-9-22(4)14(6-7-16(22)19(27)28)13(15)11-25-17(23)10-18(24)26/h10,13-16,25H,6-9,11-12H2,1-5H3,(H,27,28)(H,29,30)