3-[3-[2-(4-methoxyphenyl)azepan-1-yl]-3-oxidanylidene-propyl]quinazolin-4-one

Systemtic Name: 3-[3-[2-(4-methoxyphenyl)azepan-1-yl]-3-oxidanylidene-propyl]quinazolin-4-one Openeye Name: 3-[3-[2-(4-methoxyphenyl)azepan-1-yl]-3-oxo-propyl]quinazolin-4-one CAS Name: 3-[3-[2-(4-methoxyphenyl)-1-azepanyl]-3-oxopropyl]-4-quinazolinone IUPAC Name: 3-[3-[2-(4-methoxyphenyl)azepan-1-yl]-3-oxopropyl]quinazolin-4-one Traditional Name: 3-[3-keto-3-[2-(4-methoxyphenyl)azepan-1-yl]propyl]quinazolin-4-one Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCCCN2C(=O)CCN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

COC1=CC=C(C=C1)C2CCCCCN2C(=O)CCN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C24H27N3O3/c1-30-19-12-10-18(11-13-19)22-9-3-2-6-15-27(22)23(28)14-16-26-17-25-21-8-5-4-7-20(21)24(26)29/h4-5,7-8,10-13,17,22H,2-3,6,9,14-16H2,1H3