4-[(3-methylimidazol-4-yl)-[(2-nitrophenyl)methoxy]methyl]-2-(2-methylphenyl)benzenecarbonitrile

Systemtic Name: 4-[(3-methylimidazol-4-yl)-[(2-nitrophenyl)methoxy]methyl]-2-(2-methylphenyl)benzenecarbonitrile Openeye Name: 4-[(3-methylimidazol-4-yl)-[(2-nitrophenyl)methoxy]methyl]-2-(o-tolyl)benzonitrile CAS Name: 4-[(3-methyl-4-imidazolyl)-[(2-nitrophenyl)methoxy]methyl]-2-(2-methylphenyl)benzonitrile IUPAC Name: 4-[(3-methylimidazol-4-yl)-[(2-nitrophenyl)methoxy]methyl]-2-(2-methylphenyl)benzonitrile Traditional Name: 4-[(3-methylimidazol-4-yl)-(2-nitrobenzyl)oxy-methyl]-2-(o-tolyl)benzonitrile Formula: C26H22N4O3 MolecularWeight: 438.47788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C=CC(=C2)C(C3=CN=CN3C)OCC4=CC=CC=C4[N+](=O)[O-])C#N

Isomeric SMILES

CC1=CC=CC=C1C2=C(C=CC(=C2)C(C3=CN=CN3C)OCC4=CC=CC=C4[N+](=O)[O-])C#N

InChI

InChI=1S/C26H22N4O3/c1-18-7-3-5-9-22(18)23-13-19(11-12-20(23)14-27)26(25-15-28-17-29(25)2)33-16-21-8-4-6-10-24(21)30(31)32/h3-13,15,17,26H,16H2,1-2H3