[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl 3-nitrobenzoate

Systemtic Name: [5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl 3-nitrobenzoate Openeye Name: [5-(m-tolyl)-1,3,4-oxadiazol-2-yl]methyl 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [5-(m-tolyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C17H13N3O5 MolecularWeight: 339.30222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN=C(O2)COC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(O2)COC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O5/c1-11-4-2-5-12(8-11)16-19-18-15(25-16)10-24-17(21)13-6-3-7-14(9-13)20(22)23/h2-9H,10H2,1H3