4-methyl-3-nitro-N-(2-prop-2-enyl-1,2,3,4-tetrazol-5-yl)benzamide

Systemtic Name: 4-methyl-3-nitro-N-(2-prop-2-enyl-1,2,3,4-tetrazol-5-yl)benzamide Openeye Name: N-(2-allyltetrazol-5-yl)-4-methyl-3-nitro-benzamide CAS Name: 4-methyl-3-nitro-N-(2-prop-2-enyl-5-tetrazolyl)benzamide IUPAC Name: 4-methyl-3-nitro-N-(2-prop-2-enyltetrazol-5-yl)benzamide Traditional Name: N-(2-allyltetrazol-5-yl)-4-methyl-3-nitro-benzamide Formula: C12H12N6O3 MolecularWeight: 288.26208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=NN(N=N2)CC=C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=NN(N=N2)CC=C)[N+](=O)[O-]

InChI

InChI=1S/C12H12N6O3/c1-3-6-17-15-12(14-16-17)13-11(19)9-5-4-8(2)10(7-9)18(20)21/h3-5,7H,1,6H2,2H3,(H,13,15,19)