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

Systemtic Name: N-[[1-(4-ethoxyphenyl)-1,2,3,4-tetrazol-5-yl]methyl]-3-nitro-benzamide Openeye Name: N-[[1-(4-ethoxyphenyl)tetrazol-5-yl]methyl]-3-nitro-benzamide CAS Name: N-[[1-(4-ethoxyphenyl)-5-tetrazolyl]methyl]-3-nitrobenzamide IUPAC Name: N-[[1-(4-ethoxyphenyl)tetrazol-5-yl]methyl]-3-nitrobenzamide Traditional Name: 3-nitro-N-[(1-p-phenetyltetrazol-5-yl)methyl]benzamide Formula: C17H16N6O4 MolecularWeight: 368.34674

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=NN=N2)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=NN=N2)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H16N6O4/c1-2-27-15-8-6-13(7-9-15)22-16(19-20-21-22)11-18-17(24)12-4-3-5-14(10-12)23(25)26/h3-10H,2,11H2,1H3,(H,18,24)