(3S)-3-(3,4-dimethoxyphenyl)-3-[(2-methylphenyl)carbonylamino]propanoic acid

Systemtic Name: (3S)-3-(3,4-dimethoxyphenyl)-3-[(2-methylphenyl)carbonylamino]propanoic acid Openeye Name: (3S)-3-(3,4-dimethoxyphenyl)-3-[(2-methylbenzoyl)amino]propanoic acid CAS Name: (3S)-3-(3,4-dimethoxyphenyl)-3-[[(2-methylphenyl)-oxomethyl]amino]propanoic acid IUPAC Name: (3S)-3-(3,4-dimethoxyphenyl)-3-[(2-methylbenzoyl)amino]propanoic acid Traditional Name: (3S)-3-(3,4-dimethoxyphenyl)-3-(o-toluoylamino)propionic acid Formula: C19H21NO5 MolecularWeight: 343.37374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC(CC(=O)O)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC1=CC=CC=C1C(=O)N[C@@H](CC(=O)O)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C19H21NO5/c1-12-6-4-5-7-14(12)19(23)20-15(11-18(21)22)13-8-9-16(24-2)17(10-13)25-3/h4-10,15H,11H2,1-3H3,(H,20,23)(H,21,22)/t15-/m0/s1