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

Systemtic Name: (3-ethoxycarbonylphenyl)methyl 4-methyl-3-(propanoylamino)benzoate Openeye Name: (3-ethoxycarbonylphenyl)methyl 4-methyl-3-(propanoylamino)benzoate CAS Name: 4-methyl-3-(1-oxopropylamino)benzoic acid (3-ethoxycarbonylphenyl)methyl ester IUPAC Name: (3-ethoxycarbonylphenyl)methyl 4-methyl-3-(propanoylamino)benzoate Traditional Name: 4-methyl-3-propionamido-benzoic acid (3-carbethoxybenzyl) ester Formula: C21H23NO5 MolecularWeight: 369.41102

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C=CC(=C1)C(=O)OCC2=CC=CC(=C2)C(=O)OCC)C

Isomeric SMILES

CCC(=O)NC1=C(C=CC(=C1)C(=O)OCC2=CC=CC(=C2)C(=O)OCC)C

InChI

InChI=1S/C21H23NO5/c1-4-19(23)22-18-12-17(10-9-14(18)3)21(25)27-13-15-7-6-8-16(11-15)20(24)26-5-2/h6-12H,4-5,13H2,1-3H3,(H,22,23)