4-[4-[(2,6-dimethylphenyl)carbonylamino]phenyl]butanoic acid

Systemtic Name: 4-[4-[(2,6-dimethylphenyl)carbonylamino]phenyl]butanoic acid Openeye Name: 4-[4-[(2,6-dimethylbenzoyl)amino]phenyl]butanoic acid CAS Name: 4-[4-[[(2,6-dimethylphenyl)-oxomethyl]amino]phenyl]butanoic acid IUPAC Name: 4-[4-[(2,6-dimethylbenzoyl)amino]phenyl]butanoic acid Traditional Name: 4-[4-[(2,6-dimethylbenzoyl)amino]phenyl]butyric acid Formula: C19H21NO3 MolecularWeight: 311.37494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C(=O)NC2=CC=C(C=C2)CCCC(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)C(=O)NC2=CC=C(C=C2)CCCC(=O)O

InChI

InChI=1S/C19H21NO3/c1-13-5-3-6-14(2)18(13)19(23)20-16-11-9-15(10-12-16)7-4-8-17(21)22/h3,5-6,9-12H,4,7-8H2,1-2H3,(H,20,23)(H,21,22)