3-(azepan-1-ylcarbonyl)-1-(4-methoxyphenyl)-7,7-dimethyl-6,8-dihydroquinoline-2,5-dione

Systemtic Name: 3-(azepan-1-ylcarbonyl)-1-(4-methoxyphenyl)-7,7-dimethyl-6,8-dihydroquinoline-2,5-dione Openeye Name: 3-(azepane-1-carbonyl)-1-(4-methoxyphenyl)-7,7-dimethyl-6,8-dihydroquinoline-2,5-dione CAS Name: 3-[1-azepanyl(oxo)methyl]-1-(4-methoxyphenyl)-7,7-dimethyl-6,8-dihydroquinoline-2,5-dione IUPAC Name: 3-(azepane-1-carbonyl)-1-(4-methoxyphenyl)-7,7-dimethyl-6,8-dihydroquinoline-2,5-dione Traditional Name: 3-(azepane-1-carbonyl)-1-(4-methoxyphenyl)-7,7-dimethyl-6,8-dihydroquinoline-2,5-quinone Formula: C25H30N2O4 MolecularWeight: 422.5167

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C=C(C(=O)N2C3=CC=C(C=C3)OC)C(=O)N4CCCCCC4)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C=C(C(=O)N2C3=CC=C(C=C3)OC)C(=O)N4CCCCCC4)C(=O)C1)C

InChI

InChI=1S/C25H30N2O4/c1-25(2)15-21-19(22(28)16-25)14-20(23(29)26-12-6-4-5-7-13-26)24(30)27(21)17-8-10-18(31-3)11-9-17/h8-11,14H,4-7,12-13,15-16H2,1-3H3