(3-ethoxycarbonylphenyl)methyl 4-methyl-3-nitro-benzoate

Systemtic Name: (3-ethoxycarbonylphenyl)methyl 4-methyl-3-nitro-benzoate Openeye Name: (3-ethoxycarbonylphenyl)methyl 4-methyl-3-nitro-benzoate CAS Name: 4-methyl-3-nitrobenzoic acid (3-ethoxycarbonylphenyl)methyl ester IUPAC Name: (3-ethoxycarbonylphenyl)methyl 4-methyl-3-nitrobenzoate Traditional Name: 4-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=CC(=C(C=C2)C)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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