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

Systemtic Name: 4-ethoxy-3-nitro-N-(2-prop-2-enyl-1,2,3,4-tetrazol-5-yl)benzamide Openeye Name: N-(2-allyltetrazol-5-yl)-4-ethoxy-3-nitro-benzamide CAS Name: 4-ethoxy-3-nitro-N-(2-prop-2-enyl-5-tetrazolyl)benzamide IUPAC Name: 4-ethoxy-3-nitro-N-(2-prop-2-enyltetrazol-5-yl)benzamide Traditional Name: N-(2-allyltetrazol-5-yl)-4-ethoxy-3-nitro-benzamide Formula: C13H14N6O4 MolecularWeight: 318.28806

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=NN(N=N2)CC=C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=NN(N=N2)CC=C)[N+](=O)[O-]

InChI

InChI=1S/C13H14N6O4/c1-3-7-18-16-13(15-17-18)14-12(20)9-5-6-11(23-4-2)10(8-9)19(21)22/h3,5-6,8H,1,4,7H2,2H3,(H,14,16,20)