3-(4-tert-butylphenyl)-3-[(3-methylphenyl)carbonylamino]propanoic acid

Systemtic Name: 3-(4-tert-butylphenyl)-3-[(3-methylphenyl)carbonylamino]propanoic acid Openeye Name: 3-(4-tert-butylphenyl)-3-[(3-methylbenzoyl)amino]propanoic acid CAS Name: 3-(4-tert-butylphenyl)-3-[[(3-methylphenyl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-(4-tert-butylphenyl)-3-[(3-methylbenzoyl)amino]propanoic acid Traditional Name: 3-(4-tert-butylphenyl)-3-(m-toluoylamino)propionic acid Formula: C21H25NO3 MolecularWeight: 339.4281

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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)C(C)(C)C

Isomeric SMILES

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

InChI

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