4-[(2,3-dimethylphenyl)carbonyl-methyl-amino]butanoic acid

Systemtic Name: 4-[(2,3-dimethylphenyl)carbonyl-methyl-amino]butanoic acid Openeye Name: 4-[(2,3-dimethylbenzoyl)-methyl-amino]butanoic acid CAS Name: 4-[[(2,3-dimethylphenyl)-oxomethyl]-methylamino]butanoic acid IUPAC Name: 4-[(2,3-dimethylbenzoyl)-methylamino]butanoic acid Traditional Name: 4-[(2,3-dimethylbenzoyl)-methyl-amino]butyric acid Formula: C14H19NO3 MolecularWeight: 249.30556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1C)C(=O)N(C)CCCC(=O)O

Isomeric SMILES

CC1=CC=CC(=C1C)C(=O)N(C)CCCC(=O)O

InChI

InChI=1S/C14H19NO3/c1-10-6-4-7-12(11(10)2)14(18)15(3)9-5-8-13(16)17/h4,6-7H,5,8-9H2,1-3H3,(H,16,17)