2-chloranyl-N-(3-methoxypropyl)-4-nitro-N-[1-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)propyl]benzamide

Systemtic Name: 2-chloranyl-N-(3-methoxypropyl)-4-nitro-N-[1-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)propyl]benzamide Openeye Name: 2-chloro-N-(3-methoxypropyl)-4-nitro-N-[1-(4-oxo-3-phenyl-quinazolin-2-yl)propyl]benzamide CAS Name: 2-chloro-N-(3-methoxypropyl)-4-nitro-N-[1-(4-oxo-3-phenyl-2-quinazolinyl)propyl]benzamide IUPAC Name: 2-chloro-N-(3-methoxypropyl)-4-nitro-N-[1-(4-oxo-3-phenylquinazolin-2-yl)propyl]benzamide Traditional Name: 2-chloro-N-[1-(4-keto-3-phenyl-quinazolin-2-yl)propyl]-N-(3-methoxypropyl)-4-nitro-benzamide Formula: C28H27ClN4O5 MolecularWeight: 534.99078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H27ClN4O5/c1-3-25(31(16-9-17-38-2)27(34)21-15-14-20(33(36)37)18-23(21)29)26-30-24-13-8-7-12-22(24)28(35)32(26)19-10-5-4-6-11-19/h4-8,10-15,18,25H,3,9,16-17H2,1-2H3