4-[[[3-(1-methyl-1,2,3,4-tetrazol-5-yl)phenyl]amino]methyl]-3-nitro-benzamide

Systemtic Name: 4-[[[3-(1-methyl-1,2,3,4-tetrazol-5-yl)phenyl]amino]methyl]-3-nitro-benzamide Openeye Name: 4-[[3-(1-methyltetrazol-5-yl)anilino]methyl]-3-nitro-benzamide CAS Name: 4-[[3-(1-methyl-5-tetrazolyl)anilino]methyl]-3-nitrobenzamide IUPAC Name: 4-[[3-(1-methyltetrazol-5-yl)anilino]methyl]-3-nitrobenzamide Traditional Name: 4-[[3-(1-methyltetrazol-5-yl)anilino]methyl]-3-nitro-benzamide Formula: C16H15N7O3 MolecularWeight: 353.3354

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)C2=CC(=CC=C2)NCC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CN1C(=NN=N1)C2=CC(=CC=C2)NCC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H15N7O3/c1-22-16(19-20-21-22)11-3-2-4-13(7-11)18-9-12-6-5-10(15(17)24)8-14(12)23(25)26/h2-8,18H,9H2,1H3,(H2,17,24)