4-[[2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]amino]-3-phenyl-butanoic acid

Systemtic Name: 4-[[2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]amino]-3-phenyl-butanoic acid Openeye Name: 4-[[2-(2,5-dimethylanilino)-2-oxo-ethyl]amino]-3-phenyl-butanoic acid CAS Name: 4-[[2-(2,5-dimethylanilino)-2-oxoethyl]amino]-3-phenylbutanoic acid IUPAC Name: 4-[[2-(2,5-dimethylanilino)-2-oxoethyl]amino]-3-phenylbutanoic acid Traditional Name: 4-[[2-(2,5-dimethylanilino)-2-keto-ethyl]amino]-3-phenyl-butyric acid Formula: C20H24N2O3 MolecularWeight: 340.41616

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O3/c1-14-8-9-15(2)18(10-14)22-19(23)13-21-12-17(11-20(24)25)16-6-4-3-5-7-16/h3-10,17,21H,11-13H2,1-2H3,(H,22,23)(H,24,25)