3-[2-(4-methoxyphenyl)azepan-1-yl]carbonyl-1,6,7,8-tetrahydroquinoline-2,5-dione

Systemtic Name: 3-[2-(4-methoxyphenyl)azepan-1-yl]carbonyl-1,6,7,8-tetrahydroquinoline-2,5-dione Openeye Name: 3-[2-(4-methoxyphenyl)azepane-1-carbonyl]-1,6,7,8-tetrahydroquinoline-2,5-dione CAS Name: 3-[[2-(4-methoxyphenyl)-1-azepanyl]-oxomethyl]-1,6,7,8-tetrahydroquinoline-2,5-dione IUPAC Name: 3-[2-(4-methoxyphenyl)azepane-1-carbonyl]-1,6,7,8-tetrahydroquinoline-2,5-dione Traditional Name: 3-[2-(4-methoxyphenyl)azepane-1-carbonyl]-1,6,7,8-tetrahydroquinoline-2,5-quinone Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCCCN2C(=O)C3=CC4=C(CCCC4=O)NC3=O

Isomeric SMILES

COC1=CC=C(C=C1)C2CCCCCN2C(=O)C3=CC4=C(CCCC4=O)NC3=O

InChI

InChI=1S/C23H26N2O4/c1-29-16-11-9-15(10-12-16)20-7-3-2-4-13-25(20)23(28)18-14-17-19(24-22(18)27)6-5-8-21(17)26/h9-12,14,20H,2-8,13H2,1H3,(H,24,27)