4,5-dimethyl-N-[(5-methylbenzotriazol-1-yl)methyl]-2-nitro-aniline

Systemtic Name: 4,5-dimethyl-N-[(5-methylbenzotriazol-1-yl)methyl]-2-nitro-aniline Openeye Name: 4,5-dimethyl-N-[(5-methylbenzotriazol-1-yl)methyl]-2-nitro-aniline CAS Name: 4,5-dimethyl-N-[(5-methyl-1-benzotriazolyl)methyl]-2-nitroaniline IUPAC Name: 4,5-dimethyl-N-[(5-methylbenzotriazol-1-yl)methyl]-2-nitroaniline Traditional Name: (4,5-dimethyl-2-nitro-phenyl)-[(5-methylbenzotriazol-1-yl)methyl]amine Formula: C16H17N5O2 MolecularWeight: 311.33848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(N=N2)CNC3=C(C=C(C(=C3)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N(N=N2)CNC3=C(C=C(C(=C3)C)C)[N+](=O)[O-]

InChI

InChI=1S/C16H17N5O2/c1-10-4-5-15-14(6-10)18-19-20(15)9-17-13-7-11(2)12(3)8-16(13)21(22)23/h4-8,17H,9H2,1-3H3