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

Systemtic Name: N-[1-[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-4-methyl-3-nitro-N-phenethyl-benzamide Openeye Name: N-[1-[3-(4-ethylphenyl)-4-oxo-quinazolin-2-yl]propyl]-4-methyl-3-nitro-N-phenethyl-benzamide CAS Name: N-[1-[3-(4-ethylphenyl)-4-oxo-2-quinazolinyl]propyl]-4-methyl-3-nitro-N-phenethylbenzamide IUPAC Name: N-[1-[3-(4-ethylphenyl)-4-oxoquinazolin-2-yl]propyl]-4-methyl-3-nitro-N-phenethylbenzamide Traditional Name: N-[1-[3-(4-ethylphenyl)-4-keto-quinazolin-2-yl]propyl]-4-methyl-3-nitro-N-phenethyl-benzamide Formula: C35H34N4O4 MolecularWeight: 574.66886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(CC)N(CCC4=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(CCC4=CC=CC=C4)C(=O)C5=CC(=C(C=C5)C)[N+](=O)[O-]

InChI

InChI=1S/C35H34N4O4/c1-4-25-16-19-28(20-17-25)38-33(36-30-14-10-9-13-29(30)35(38)41)31(5-2)37(22-21-26-11-7-6-8-12-26)34(40)27-18-15-24(3)32(23-27)39(42)43/h6-20,23,31H,4-5,21-22H2,1-3H3