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

Systemtic Name: (3-ethoxycarbonylphenyl)methyl 2-methyl-3-nitro-benzoate Openeye Name: (3-ethoxycarbonylphenyl)methyl 2-methyl-3-nitro-benzoate CAS Name: 2-methyl-3-nitrobenzoic acid (3-ethoxycarbonylphenyl)methyl ester IUPAC Name: (3-ethoxycarbonylphenyl)methyl 2-methyl-3-nitrobenzoate Traditional Name: 2-methyl-3-nitro-benzoic acid (3-carbethoxybenzyl) ester Formula: C18H17NO6 MolecularWeight: 343.33068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17NO6/c1-3-24-17(20)14-7-4-6-13(10-14)11-25-18(21)15-8-5-9-16(12(15)2)19(22)23/h4-10H,3,11H2,1-2H3