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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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