(2-nitrophenyl)methyl 3,4-dimethylbenzoate

Systemtic Name: (2-nitrophenyl)methyl 3,4-dimethylbenzoate Openeye Name: (2-nitrophenyl)methyl 3,4-dimethylbenzoate CAS Name: 3,4-dimethylbenzoic acid (2-nitrophenyl)methyl ester IUPAC Name: (2-nitrophenyl)methyl 3,4-dimethylbenzoate Traditional Name: 3,4-dimethylbenzoic acid (2-nitrobenzyl) ester Formula: C16H15NO4 MolecularWeight: 285.2946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15NO4/c1-11-7-8-13(9-12(11)2)16(18)21-10-14-5-3-4-6-15(14)17(19)20/h3-9H,10H2,1-2H3