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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])N3C=NN=N3

Isomeric SMILES

CC1=C(C=CC(=C1)NCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])N3C=NN=N3

InChI

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