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

Systemtic Name: N-[1-[3-(2-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-4-nitro-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-N-[1-[3-(2-methoxyphenyl)-4-oxo-quinazolin-2-yl]propyl]-4-nitro-benzamide CAS Name: N-[1-[3-(2-methoxyphenyl)-4-oxo-2-quinazolinyl]propyl]-4-nitro-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-N-[1-[3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]propyl]-4-nitrobenzamide Traditional Name: N-benzyl-N-[1-[4-keto-3-(2-methoxyphenyl)quinazolin-2-yl]propyl]-4-nitro-benzamide Formula: C32H28N4O5 MolecularWeight: 548.58852

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3OC)N(CC4=CC=CC=C4)C(=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CCC(C1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3OC)N(CC4=CC=CC=C4)C(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C32H28N4O5/c1-3-27(34(21-22-11-5-4-6-12-22)31(37)23-17-19-24(20-18-23)36(39)40)30-33-26-14-8-7-13-25(26)32(38)35(30)28-15-9-10-16-29(28)41-2/h4-20,27H,3,21H2,1-2H3