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

Systemtic Name: N-[1-[3-(3-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-N-hexyl-3-nitro-benzamide Openeye Name: N-[1-[3-(3-chlorophenyl)-4-oxo-quinazolin-2-yl]propyl]-N-hexyl-3-nitro-benzamide CAS Name: N-[1-[3-(3-chlorophenyl)-4-oxo-2-quinazolinyl]propyl]-N-hexyl-3-nitrobenzamide IUPAC Name: N-[1-[3-(3-chlorophenyl)-4-oxoquinazolin-2-yl]propyl]-N-hexyl-3-nitrobenzamide Traditional Name: N-[1-[3-(3-chlorophenyl)-4-keto-quinazolin-2-yl]propyl]-N-hexyl-3-nitro-benzamide Formula: C30H31ClN4O4 MolecularWeight: 547.04454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H31ClN4O4/c1-3-5-6-9-18-33(29(36)21-12-10-15-24(19-21)35(38)39)27(4-2)28-32-26-17-8-7-16-25(26)30(37)34(28)23-14-11-13-22(31)20-23/h7-8,10-17,19-20,27H,3-6,9,18H2,1-2H3