(3S)-3-(4-ethoxy-3-methoxy-phenyl)-3-[(3-methylphenyl)carbonylamino]propanoate

Systemtic Name: (3S)-3-(4-ethoxy-3-methoxy-phenyl)-3-[(3-methylphenyl)carbonylamino]propanoate Openeye Name: (3S)-3-(4-ethoxy-3-methoxy-phenyl)-3-[(3-methylbenzoyl)amino]propanoate CAS Name: (3S)-3-(4-ethoxy-3-methoxyphenyl)-3-[[(3-methylphenyl)-oxomethyl]amino]propanoate IUPAC Name: (3S)-3-(4-ethoxy-3-methoxyphenyl)-3-[(3-methylbenzoyl)amino]propanoate Traditional Name: (3S)-3-(4-ethoxy-3-methoxy-phenyl)-3-(m-toluoylamino)propionate Formula: C20H22NO5- MolecularWeight: 356.39238

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(CC(=O)[O-])NC(=O)C2=CC(=CC=C2)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[C@H](CC(=O)[O-])NC(=O)C2=CC(=CC=C2)C)OC

InChI

InChI=1S/C20H23NO5/c1-4-26-17-9-8-14(11-18(17)25-3)16(12-19(22)23)21-20(24)15-7-5-6-13(2)10-15/h5-11,16H,4,12H2,1-3H3,(H,21,24)(H,22,23)/p-1/t16-/m0/s1