N-[1-[3-(2-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-N-hexyl-3-nitro-benzamide

Systemtic Name: N-[1-[3-(2-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-N-hexyl-3-nitro-benzamide Openeye Name: N-[1-[3-(2-chlorophenyl)-4-oxo-quinazolin-2-yl]ethyl]-N-hexyl-3-nitro-benzamide CAS Name: N-[1-[3-(2-chlorophenyl)-4-oxo-2-quinazolinyl]ethyl]-N-hexyl-3-nitrobenzamide IUPAC Name: N-[1-[3-(2-chlorophenyl)-4-oxoquinazolin-2-yl]ethyl]-N-hexyl-3-nitrobenzamide Traditional Name: N-[1-[3-(2-chlorophenyl)-4-keto-quinazolin-2-yl]ethyl]-N-hexyl-3-nitro-benzamide Formula: C29H29ClN4O4 MolecularWeight: 533.01796

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3Cl)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCCCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3Cl)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

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