3-nitro-4-[5-(4-propan-2-ylphenyl)-1,2,3,4-tetrazol-2-yl]benzamide

Systemtic Name: 3-nitro-4-[5-(4-propan-2-ylphenyl)-1,2,3,4-tetrazol-2-yl]benzamide Openeye Name: 4-[5-(4-isopropylphenyl)tetrazol-2-yl]-3-nitro-benzamide CAS Name: 3-nitro-4-[5-(4-propan-2-ylphenyl)-2-tetrazolyl]benzamide IUPAC Name: 3-nitro-4-[5-(4-propan-2-ylphenyl)tetrazol-2-yl]benzamide Traditional Name: 3-nitro-4-(5-p-cumenyltetrazol-2-yl)benzamide Formula: C17H16N6O3 MolecularWeight: 352.34734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NN(N=N2)C3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NN(N=N2)C3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C17H16N6O3/c1-10(2)11-3-5-12(6-4-11)17-19-21-22(20-17)14-8-7-13(16(18)24)9-15(14)23(25)26/h3-10H,1-2H3,(H2,18,24)