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

Systemtic Name: 5-chloranyl-N-[[1-(4-methoxyphenyl)-1,2,3,4-tetrazol-5-yl]methyl]-2-nitro-benzamide Openeye Name: 5-chloro-N-[[1-(4-methoxyphenyl)tetrazol-5-yl]methyl]-2-nitro-benzamide CAS Name: 5-chloro-N-[[1-(4-methoxyphenyl)-5-tetrazolyl]methyl]-2-nitrobenzamide IUPAC Name: 5-chloro-N-[[1-(4-methoxyphenyl)tetrazol-5-yl]methyl]-2-nitrobenzamide Traditional Name: 5-chloro-N-[[1-(4-methoxyphenyl)tetrazol-5-yl]methyl]-2-nitro-benzamide Formula: C16H13ClN6O4 MolecularWeight: 388.76522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=NN=N2)CNC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=NN=N2)CNC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H13ClN6O4/c1-27-12-5-3-11(4-6-12)22-15(19-20-21-22)9-18-16(24)13-8-10(17)2-7-14(13)23(25)26/h2-8H,9H2,1H3,(H,18,24)