4-methyl-N-[6-methyl-2-(4-methylphenyl)benzotriazol-5-yl]-3-nitro-benzamide

Systemtic Name: 4-methyl-N-[6-methyl-2-(4-methylphenyl)benzotriazol-5-yl]-3-nitro-benzamide Openeye Name: 4-methyl-N-[6-methyl-2-(p-tolyl)benzotriazol-5-yl]-3-nitro-benzamide CAS Name: 4-methyl-N-[6-methyl-2-(4-methylphenyl)-5-benzotriazolyl]-3-nitrobenzamide IUPAC Name: 4-methyl-N-[6-methyl-2-(4-methylphenyl)benzotriazol-5-yl]-3-nitrobenzamide Traditional Name: 4-methyl-N-[6-methyl-2-(p-tolyl)benzotriazol-5-yl]-3-nitro-benzamide Formula: C22H19N5O3 MolecularWeight: 401.41796

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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(=C(C=C4)C)[N+](=O)[O-])C

Isomeric SMILES

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

InChI

InChI=1S/C22H19N5O3/c1-13-4-8-17(9-5-13)26-24-19-10-15(3)18(12-20(19)25-26)23-22(28)16-7-6-14(2)21(11-16)27(29)30/h4-12H,1-3H3,(H,23,28)