7-(azepan-1-ylcarbonyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]-1H-quinazoline-2,4-dione

Systemtic Name: 7-(azepan-1-ylcarbonyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]-1H-quinazoline-2,4-dione Openeye Name: 7-(azepane-1-carbonyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]-1H-quinazoline-2,4-dione CAS Name: 7-[1-azepanyl(oxo)methyl]-3-[2-(3,4-dimethoxyphenyl)ethyl]-1H-quinazoline-2,4-dione IUPAC Name: 7-(azepane-1-carbonyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]-1H-quinazoline-2,4-dione Traditional Name: 7-(azepane-1-carbonyl)-3-homoveratryl-1H-quinazoline-2,4-quinone Formula: C25H29N3O5 MolecularWeight: 451.51486

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2C(=O)C3=C(C=C(C=C3)C(=O)N4CCCCCC4)NC2=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2C(=O)C3=C(C=C(C=C3)C(=O)N4CCCCCC4)NC2=O)OC

InChI

InChI=1S/C25H29N3O5/c1-32-21-10-7-17(15-22(21)33-2)11-14-28-24(30)19-9-8-18(16-20(19)26-25(28)31)23(29)27-12-5-3-4-6-13-27/h7-10,15-16H,3-6,11-14H2,1-2H3,(H,26,31)