11-methyl-3,8-bis[(1-oxidanylcyclohexyl)carbonyl]benzo[b][1]benzazepine-5,6-dione

Systemtic Name: 11-methyl-3,8-bis[(1-oxidanylcyclohexyl)carbonyl]benzo[b][1]benzazepine-5,6-dione Openeye Name: 3,8-bis(1-hydroxycyclohexanecarbonyl)-11-methyl-benzo[b][1]benzazepine-5,6-dione CAS Name: 3,8-bis[(1-hydroxycyclohexyl)-oxomethyl]-11-methylbenzo[b][1]benzazepine-5,6-dione IUPAC Name: 3,8-bis(1-hydroxycyclohexanecarbonyl)-11-methylbenzo[b][1]benzazepine-5,6-dione Traditional Name: 3,8-bis(1-hydroxycyclohexanecarbonyl)-11-methyl-benzo[b][1]benzazepine-5,6-quinone Formula: C29H31NO6 MolecularWeight: 489.55954

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)C3(CCCCC3)O)C(=O)C(=O)C4=C1C=CC(=C4)C(=O)C5(CCCCC5)O

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)C3(CCCCC3)O)C(=O)C(=O)C4=C1C=CC(=C4)C(=O)C5(CCCCC5)O

InChI

InChI=1S/C29H31NO6/c1-30-22-10-8-18(26(33)28(35)12-4-2-5-13-28)16-20(22)24(31)25(32)21-17-19(9-11-23(21)30)27(34)29(36)14-6-3-7-15-29/h8-11,16-17,35-36H,2-7,12-15H2,1H3