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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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