N-[1-[3-(3-chloranyl-2-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-3-nitro-N-pentyl-benzamide

Systemtic Name: N-[1-[3-(3-chloranyl-2-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-3-nitro-N-pentyl-benzamide Openeye Name: N-[1-[3-(3-chloro-2-methyl-phenyl)-4-oxo-quinazolin-2-yl]ethyl]-3-nitro-N-pentyl-benzamide CAS Name: N-[1-[3-(3-chloro-2-methylphenyl)-4-oxo-2-quinazolinyl]ethyl]-3-nitro-N-pentylbenzamide IUPAC Name: N-[1-[3-(3-chloro-2-methylphenyl)-4-oxoquinazolin-2-yl]ethyl]-3-nitro-N-pentylbenzamide Traditional Name: N-amyl-N-[1-[3-(3-chloro-2-methyl-phenyl)-4-keto-quinazolin-2-yl]ethyl]-3-nitro-benzamide Formula: C29H29ClN4O4 MolecularWeight: 533.01796

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=C(C(=CC=C3)Cl)C)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=C(C(=CC=C3)Cl)C)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C29H29ClN4O4/c1-4-5-8-17-32(28(35)21-11-9-12-22(18-21)34(37)38)20(3)27-31-25-15-7-6-13-23(25)29(36)33(27)26-16-10-14-24(30)19(26)2/h6-7,9-16,18,20H,4-5,8,17H2,1-3H3