(3-cyanophenyl)methyl 3-methyl-2-nitro-benzoate

Systemtic Name: (3-cyanophenyl)methyl 3-methyl-2-nitro-benzoate Openeye Name: (3-cyanophenyl)methyl 3-methyl-2-nitro-benzoate CAS Name: 3-methyl-2-nitrobenzoic acid (3-cyanophenyl)methyl ester IUPAC Name: (3-cyanophenyl)methyl 3-methyl-2-nitrobenzoate Traditional Name: 3-methyl-2-nitro-benzoic acid (3-cyanobenzyl) ester Formula: C16H12N2O4 MolecularWeight: 296.27748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)OCC2=CC=CC(=C2)C#N

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)OCC2=CC=CC(=C2)C#N

InChI

InChI=1S/C16H12N2O4/c1-11-4-2-7-14(15(11)18(20)21)16(19)22-10-13-6-3-5-12(8-13)9-17/h2-8H,10H2,1H3