1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-3-(4-methylphenyl)quinazoline-2,4-dione

Systemtic Name: 1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-3-(4-methylphenyl)quinazoline-2,4-dione Openeye Name: 1-[2-(azepan-1-yl)-2-oxo-ethyl]-3-(p-tolyl)quinazoline-2,4-dione CAS Name: 1-[2-(1-azepanyl)-2-oxoethyl]-3-(4-methylphenyl)quinazoline-2,4-dione IUPAC Name: 1-[2-(azepan-1-yl)-2-oxoethyl]-3-(4-methylphenyl)quinazoline-2,4-dione Traditional Name: 1-[2-(azepan-1-yl)-2-keto-ethyl]-3-(p-tolyl)quinazoline-2,4-quinone Formula: C23H25N3O3 MolecularWeight: 391.4629

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N(C2=O)CC(=O)N4CCCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N(C2=O)CC(=O)N4CCCCCC4

InChI

InChI=1S/C23H25N3O3/c1-17-10-12-18(13-11-17)26-22(28)19-8-4-5-9-20(19)25(23(26)29)16-21(27)24-14-6-2-3-7-15-24/h4-5,8-13H,2-3,6-7,14-16H2,1H3