N-[(E)-1-(benzotriazol-1-yl)propan-2-ylideneamino]-2-nitro-benzamide

Systemtic Name: N-[(E)-1-(benzotriazol-1-yl)propan-2-ylideneamino]-2-nitro-benzamide Openeye Name: N-[(E)-[2-(benzotriazol-1-yl)-1-methyl-ethylidene]amino]-2-nitro-benzamide CAS Name: N-[(E)-1-(1-benzotriazolyl)propan-2-ylideneamino]-2-nitrobenzamide IUPAC Name: N-[(E)-1-(benzotriazol-1-yl)propan-2-ylideneamino]-2-nitrobenzamide Traditional Name: N-[(E)-[2-(benzotriazol-1-yl)-1-methyl-ethylidene]amino]-2-nitro-benzamide Formula: C16H14N6O3 MolecularWeight: 338.32076

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=CC=C1[N+](=O)[O-])CN2C3=CC=CC=C3N=N2

Isomeric SMILES

C/C(=N\NC(=O)C1=CC=CC=C1[N+](=O)[O-])/CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C16H14N6O3/c1-11(10-21-15-9-5-3-7-13(15)18-20-21)17-19-16(23)12-6-2-4-8-14(12)22(24)25/h2-9H,10H2,1H3,(H,19,23)/b17-11+