methyl 3-nitro-5-[1-(4-propan-2-ylphenyl)ethylcarbamoyl]benzoate

Systemtic Name: methyl 3-nitro-5-[1-(4-propan-2-ylphenyl)ethylcarbamoyl]benzoate Openeye Name: methyl 3-[1-(4-isopropylphenyl)ethylcarbamoyl]-5-nitro-benzoate CAS Name: 3-nitro-5-[oxo-[1-(4-propan-2-ylphenyl)ethylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-nitro-5-[1-(4-propan-2-ylphenyl)ethylcarbamoyl]benzoate Traditional Name: 3-nitro-5-(1-p-cumenylethylcarbamoyl)benzoic acid methyl ester Formula: C20H22N2O5 MolecularWeight: 370.39908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O5/c1-12(2)14-5-7-15(8-6-14)13(3)21-19(23)16-9-17(20(24)27-4)11-18(10-16)22(25)26/h5-13H,1-4H3,(H,21,23)