4-methyl-N-[2-(4-methylphenyl)benzotriazol-5-yl]-3-nitro-benzamide

Systemtic Name: 4-methyl-N-[2-(4-methylphenyl)benzotriazol-5-yl]-3-nitro-benzamide Openeye Name: 4-methyl-3-nitro-N-[2-(p-tolyl)benzotriazol-5-yl]benzamide CAS Name: 4-methyl-N-[2-(4-methylphenyl)-5-benzotriazolyl]-3-nitrobenzamide IUPAC Name: 4-methyl-N-[2-(4-methylphenyl)benzotriazol-5-yl]-3-nitrobenzamide Traditional Name: 4-methyl-3-nitro-N-[2-(p-tolyl)benzotriazol-5-yl]benzamide Formula: C21H17N5O3 MolecularWeight: 387.39138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C21H17N5O3/c1-13-3-8-17(9-4-13)25-23-18-10-7-16(12-19(18)24-25)22-21(27)15-6-5-14(2)20(11-15)26(28)29/h3-12H,1-2H3,(H,22,27)