(3,5-dimethylphenyl)methyl 3-methyl-2-nitro-benzoate

Systemtic Name: (3,5-dimethylphenyl)methyl 3-methyl-2-nitro-benzoate Openeye Name: (3,5-dimethylphenyl)methyl 3-methyl-2-nitro-benzoate CAS Name: 3-methyl-2-nitrobenzoic acid (3,5-dimethylphenyl)methyl ester IUPAC Name: (3,5-dimethylphenyl)methyl 3-methyl-2-nitrobenzoate Traditional Name: 3-methyl-2-nitro-benzoic acid (3,5-dimethylbenzyl) ester Formula: C17H17NO4 MolecularWeight: 299.32118

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17NO4/c1-11-7-12(2)9-14(8-11)10-22-17(19)15-6-4-5-13(3)16(15)18(20)21/h4-9H,10H2,1-3H3