(1-phenyl-1,2,3,4-tetrazol-5-yl)methyl 2-chloranyl-4-nitro-benzoate

Systemtic Name: (1-phenyl-1,2,3,4-tetrazol-5-yl)methyl 2-chloranyl-4-nitro-benzoate Openeye Name: (1-phenyltetrazol-5-yl)methyl 2-chloro-4-nitro-benzoate CAS Name: 2-chloro-4-nitrobenzoic acid (1-phenyl-5-tetrazolyl)methyl ester IUPAC Name: (1-phenyltetrazol-5-yl)methyl 2-chloro-4-nitrobenzoate Traditional Name: 2-chloro-4-nitro-benzoic acid (1-phenyltetrazol-5-yl)methyl ester Formula: C15H10ClN5O4 MolecularWeight: 359.724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H10ClN5O4/c16-13-8-11(21(23)24)6-7-12(13)15(22)25-9-14-17-18-19-20(14)10-4-2-1-3-5-10/h1-8H,9H2