ethyl 3-nitro-5-[[4-(1,2,3,4-tetrazol-1-yl)phenyl]carbamoyl]benzoate

Systemtic Name: ethyl 3-nitro-5-[[4-(1,2,3,4-tetrazol-1-yl)phenyl]carbamoyl]benzoate Openeye Name: ethyl 3-nitro-5-[[4-(tetrazol-1-yl)phenyl]carbamoyl]benzoate CAS Name: 3-nitro-5-[oxo-[4-(1-tetrazolyl)anilino]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-nitro-5-[[4-(tetrazol-1-yl)phenyl]carbamoyl]benzoate Traditional Name: 3-nitro-5-[[4-(tetrazol-1-yl)phenyl]carbamoyl]benzoic acid ethyl ester Formula: C17H14N6O5 MolecularWeight: 382.33026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)N3C=NN=N3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)N3C=NN=N3)[N+](=O)[O-]

InChI

InChI=1S/C17H14N6O5/c1-2-28-17(25)12-7-11(8-15(9-12)23(26)27)16(24)19-13-3-5-14(6-4-13)22-10-18-20-21-22/h3-10H,2H2,1H3,(H,19,24)