N-[4-(1-imidazol-1-ylpropyl)-2-nitro-phenyl]-2-(2-methylphenyl)ethanamide

Systemtic Name: N-[4-(1-imidazol-1-ylpropyl)-2-nitro-phenyl]-2-(2-methylphenyl)ethanamide Openeye Name: N-[4-(1-imidazol-1-ylpropyl)-2-nitro-phenyl]-2-(o-tolyl)acetamide CAS Name: N-[4-[1-(1-imidazolyl)propyl]-2-nitrophenyl]-2-(2-methylphenyl)acetamide IUPAC Name: N-[4-(1-imidazol-1-ylpropyl)-2-nitrophenyl]-2-(2-methylphenyl)acetamide Traditional Name: N-[4-(1-imidazol-1-ylpropyl)-2-nitro-phenyl]-2-(o-tolyl)acetamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=C(C=C1)NC(=O)CC2=CC=CC=C2C)[N+](=O)[O-])N3C=CN=C3

Isomeric SMILES

CCC(C1=CC(=C(C=C1)NC(=O)CC2=CC=CC=C2C)[N+](=O)[O-])N3C=CN=C3

InChI

InChI=1S/C21H22N4O3/c1-3-19(24-11-10-22-14-24)17-8-9-18(20(12-17)25(27)28)23-21(26)13-16-7-5-4-6-15(16)2/h4-12,14,19H,3,13H2,1-2H3,(H,23,26)