N-[6-methyl-2-(4-methylphenyl)benzotriazol-5-yl]-2-nitro-benzamide

Systemtic Name: N-[6-methyl-2-(4-methylphenyl)benzotriazol-5-yl]-2-nitro-benzamide Openeye Name: N-[6-methyl-2-(p-tolyl)benzotriazol-5-yl]-2-nitro-benzamide CAS Name: N-[6-methyl-2-(4-methylphenyl)-5-benzotriazolyl]-2-nitrobenzamide IUPAC Name: N-[6-methyl-2-(4-methylphenyl)benzotriazol-5-yl]-2-nitrobenzamide Traditional Name: N-[6-methyl-2-(p-tolyl)benzotriazol-5-yl]-2-nitro-benzamide Formula: C21H17N5O3 MolecularWeight: 387.39138

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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