(2-cyanophenyl)methyl 3-nitrobenzoate

Systemtic Name: (2-cyanophenyl)methyl 3-nitrobenzoate Openeye Name: (2-cyanophenyl)methyl 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (2-cyanobenzyl) ester Formula: C15H10N2O4 MolecularWeight: 282.2509

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H10N2O4/c16-9-12-4-1-2-5-13(12)10-21-15(18)11-6-3-7-14(8-11)17(19)20/h1-8H,10H2