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

Systemtic Name: N-[1-[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-4-methyl-3-nitro-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-N-[1-[3-(4-ethylphenyl)-4-oxo-quinazolin-2-yl]propyl]-4-methyl-3-nitro-benzamide CAS Name: N-[1-[3-(4-ethylphenyl)-4-oxo-2-quinazolinyl]propyl]-4-methyl-3-nitro-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-N-[1-[3-(4-ethylphenyl)-4-oxoquinazolin-2-yl]propyl]-4-methyl-3-nitrobenzamide Traditional Name: N-benzyl-N-[1-[3-(4-ethylphenyl)-4-keto-quinazolin-2-yl]propyl]-4-methyl-3-nitro-benzamide Formula: C34H32N4O4 MolecularWeight: 560.64228

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(CC)N(CC4=CC=CC=C4)C(=O)C5=CC(=C(C=C5)C)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(CC)N(CC4=CC=CC=C4)C(=O)C5=CC(=C(C=C5)C)[N+](=O)[O-]

InChI

InChI=1S/C34H32N4O4/c1-4-24-16-19-27(20-17-24)37-32(35-29-14-10-9-13-28(29)34(37)40)30(5-2)36(22-25-11-7-6-8-12-25)33(39)26-18-15-23(3)31(21-26)38(41)42/h6-21,30H,4-5,22H2,1-3H3