N-[(5-methylbenzotriazol-1-yl)methyl]-3-nitro-aniline

Systemtic Name: N-[(5-methylbenzotriazol-1-yl)methyl]-3-nitro-aniline Openeye Name: N-[(5-methylbenzotriazol-1-yl)methyl]-3-nitro-aniline CAS Name: N-[(5-methyl-1-benzotriazolyl)methyl]-3-nitroaniline IUPAC Name: N-[(5-methylbenzotriazol-1-yl)methyl]-3-nitroaniline Traditional Name: (5-methylbenzotriazol-1-yl)methyl-(3-nitrophenyl)amine Formula: C14H13N5O2 MolecularWeight: 283.28532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13N5O2/c1-10-5-6-14-13(7-10)16-17-18(14)9-15-11-3-2-4-12(8-11)19(20)21/h2-8,15H,9H2,1H3