N-(3-methoxypropyl)-N-[1-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]octanamide

Systemtic Name: N-(3-methoxypropyl)-N-[1-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]octanamide Openeye Name: N-(3-methoxypropyl)-N-[1-[4-oxo-3-(p-tolyl)quinazolin-2-yl]ethyl]octanamide CAS Name: N-(3-methoxypropyl)-N-[1-[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]ethyl]octanamide IUPAC Name: N-(3-methoxypropyl)-N-[1-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]ethyl]octanamide Traditional Name: N-[1-[4-keto-3-(p-tolyl)quinazolin-2-yl]ethyl]-N-(3-methoxypropyl)caprylamide Formula: C29H39N3O3 MolecularWeight: 477.63826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N(CCCOC)C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C

Isomeric SMILES

CCCCCCCC(=O)N(CCCOC)C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C

InChI

InChI=1S/C29H39N3O3/c1-5-6-7-8-9-15-27(33)31(20-12-21-35-4)23(3)28-30-26-14-11-10-13-25(26)29(34)32(28)24-18-16-22(2)17-19-24/h10-11,13-14,16-19,23H,5-9,12,15,20-21H2,1-4H3