methyl 4-methyl-3-[3-(4-propan-2-ylphenyl)propanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[3-(4-propan-2-ylphenyl)propanoylamino]benzoate Openeye Name: methyl 3-[3-(4-isopropylphenyl)propanoylamino]-4-methyl-benzoate CAS Name: 4-methyl-3-[[1-oxo-3-(4-propan-2-ylphenyl)propyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[3-(4-propan-2-ylphenyl)propanoylamino]benzoate Traditional Name: 4-methyl-3-(3-p-cumenylpropanoylamino)benzoic acid methyl ester Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CCC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CCC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C21H25NO3/c1-14(2)17-10-6-16(7-11-17)8-12-20(23)22-19-13-18(21(24)25-4)9-5-15(19)3/h5-7,9-11,13-14H,8,12H2,1-4H3,(H,22,23)