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

Systemtic Name: N-(3-methoxypropyl)-4-methyl-N-[1-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-3-nitro-benzamide Openeye Name: N-(3-methoxypropyl)-4-methyl-3-nitro-N-[1-[4-oxo-3-(p-tolyl)quinazolin-2-yl]ethyl]benzamide CAS Name: N-(3-methoxypropyl)-4-methyl-N-[1-[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]ethyl]-3-nitrobenzamide IUPAC Name: N-(3-methoxypropyl)-4-methyl-N-[1-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]ethyl]-3-nitrobenzamide Traditional Name: N-[1-[4-keto-3-(p-tolyl)quinazolin-2-yl]ethyl]-N-(3-methoxypropyl)-4-methyl-3-nitro-benzamide Formula: C29H30N4O5 MolecularWeight: 514.5723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(C)N(CCCOC)C(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(C)N(CCCOC)C(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C29H30N4O5/c1-19-10-14-23(15-11-19)32-27(30-25-9-6-5-8-24(25)29(32)35)21(3)31(16-7-17-38-4)28(34)22-13-12-20(2)26(18-22)33(36)37/h5-6,8-15,18,21H,7,16-17H2,1-4H3