4-[[4-(2,3-dimethylphenoxy)phenyl]methylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[4-(2,3-dimethylphenoxy)phenyl]methylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[4-(2,3-dimethylphenoxy)phenyl]methylamino]-4-oxo-butanoic acid CAS Name: 4-[[4-(2,3-dimethylphenoxy)phenyl]methylamino]-4-oxobutanoic acid IUPAC Name: 4-[[4-(2,3-dimethylphenoxy)phenyl]methylamino]-4-oxobutanoic acid Traditional Name: 4-[[4-(2,3-dimethylphenoxy)benzyl]amino]-4-keto-butyric acid Formula: C19H21NO4 MolecularWeight: 327.37434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OC2=CC=C(C=C2)CNC(=O)CCC(=O)O)C

Isomeric SMILES

CC1=C(C(=CC=C1)OC2=CC=C(C=C2)CNC(=O)CCC(=O)O)C

InChI

InChI=1S/C19H21NO4/c1-13-4-3-5-17(14(13)2)24-16-8-6-15(7-9-16)12-20-18(21)10-11-19(22)23/h3-9H,10-12H2,1-2H3,(H,20,21)(H,22,23)