N-[1-[7-chloranyl-3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-3-nitro-N-propyl-benzamide

Systemtic Name: N-[1-[7-chloranyl-3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-3-nitro-N-propyl-benzamide Openeye Name: N-[1-[7-chloro-4-oxo-3-(p-tolyl)quinazolin-2-yl]ethyl]-3-nitro-N-propyl-benzamide CAS Name: N-[1-[7-chloro-3-(4-methylphenyl)-4-oxo-2-quinazolinyl]ethyl]-3-nitro-N-propylbenzamide IUPAC Name: N-[1-[7-chloro-3-(4-methylphenyl)-4-oxoquinazolin-2-yl]ethyl]-3-nitro-N-propylbenzamide Traditional Name: N-[1-[7-chloro-4-keto-3-(p-tolyl)quinazolin-2-yl]ethyl]-3-nitro-N-propyl-benzamide Formula: C27H25ClN4O4 MolecularWeight: 504.9648

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C(C)C1=NC2=C(C=CC(=C2)Cl)C(=O)N1C3=CC=C(C=C3)C)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCCN(C(C)C1=NC2=C(C=CC(=C2)Cl)C(=O)N1C3=CC=C(C=C3)C)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C27H25ClN4O4/c1-4-14-30(26(33)19-6-5-7-22(15-19)32(35)36)18(3)25-29-24-16-20(28)10-13-23(24)27(34)31(25)21-11-8-17(2)9-12-21/h5-13,15-16,18H,4,14H2,1-3H3