ethyl 3-[1-(2,5-dimethylphenyl)ethylcarbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[1-(2,5-dimethylphenyl)ethylcarbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[1-(2,5-dimethylphenyl)ethylcarbamoyl]-5-nitro-benzoate CAS Name: 3-[[1-(2,5-dimethylphenyl)ethylamino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[1-(2,5-dimethylphenyl)ethylcarbamoyl]-5-nitrobenzoate Traditional Name: 3-[1-(2,5-dimethylphenyl)ethylcarbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C20H22N2O5 MolecularWeight: 370.39908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O5/c1-5-27-20(24)16-9-15(10-17(11-16)22(25)26)19(23)21-14(4)18-8-12(2)6-7-13(18)3/h6-11,14H,5H2,1-4H3,(H,21,23)