3-[(3-methylphenyl)carbonylamino]-3-(4-propan-2-yloxyphenyl)propanoic acid

Systemtic Name: 3-[(3-methylphenyl)carbonylamino]-3-(4-propan-2-yloxyphenyl)propanoic acid Openeye Name: 3-(4-isopropoxyphenyl)-3-[(3-methylbenzoyl)amino]propanoic acid CAS Name: 3-[[(3-methylphenyl)-oxomethyl]amino]-3-(4-propan-2-yloxyphenyl)propanoic acid IUPAC Name: 3-[(3-methylbenzoyl)amino]-3-(4-propan-2-yloxyphenyl)propanoic acid Traditional Name: 3-(4-isopropoxyphenyl)-3-(m-toluoylamino)propionic acid Formula: C20H23NO4 MolecularWeight: 341.40092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23NO4/c1-13(2)25-17-9-7-15(8-10-17)18(12-19(22)23)21-20(24)16-6-4-5-14(3)11-16/h4-11,13,18H,12H2,1-3H3,(H,21,24)(H,22,23)