(3-nitrophenyl)methyl 4-(1,2,3,4-tetrazol-1-yl)benzoate

Systemtic Name: (3-nitrophenyl)methyl 4-(1,2,3,4-tetrazol-1-yl)benzoate Openeye Name: (3-nitrophenyl)methyl 4-(tetrazol-1-yl)benzoate CAS Name: 4-(1-tetrazolyl)benzoic acid (3-nitrophenyl)methyl ester IUPAC Name: (3-nitrophenyl)methyl 4-(tetrazol-1-yl)benzoate Traditional Name: 4-(tetrazol-1-yl)benzoic acid (3-nitrobenzyl) ester Formula: C15H11N5O4 MolecularWeight: 325.27894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])COC(=O)C2=CC=C(C=C2)N3C=NN=N3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])COC(=O)C2=CC=C(C=C2)N3C=NN=N3

InChI

InChI=1S/C15H11N5O4/c21-15(24-9-11-2-1-3-14(8-11)20(22)23)12-4-6-13(7-5-12)19-10-16-17-18-19/h1-8,10H,9H2