methyl 3-[2-(2-methoxy-5-methyl-phenyl)ethylcarbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[2-(2-methoxy-5-methyl-phenyl)ethylcarbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[2-(2-methoxy-5-methyl-phenyl)ethylcarbamoyl]-5-nitro-benzoate CAS Name: 3-[[2-(2-methoxy-5-methylphenyl)ethylamino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[2-(2-methoxy-5-methylphenyl)ethylcarbamoyl]-5-nitrobenzoate Traditional Name: 3-[2-(2-methoxy-5-methyl-phenyl)ethylcarbamoyl]-5-nitro-benzoic acid methyl ester Formula: C19H20N2O6 MolecularWeight: 372.3719

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O6/c1-12-4-5-17(26-2)13(8-12)6-7-20-18(22)14-9-15(19(23)27-3)11-16(10-14)21(24)25/h4-5,8-11H,6-7H2,1-3H3,(H,20,22)