4-[(4-chlorophenyl)carbonyl-(2-methylbut-3-yn-2-yl)amino]butanoic acid

Systemtic Name: 4-[(4-chlorophenyl)carbonyl-(2-methylbut-3-yn-2-yl)amino]butanoic acid Openeye Name: 4-[(4-chlorobenzoyl)-(1,1-dimethylprop-2-ynyl)amino]butanoic acid CAS Name: 4-[[(4-chlorophenyl)-oxomethyl]-(2-methylbut-3-yn-2-yl)amino]butanoic acid IUPAC Name: 4-[(4-chlorobenzoyl)-(2-methylbut-3-yn-2-yl)amino]butanoic acid Traditional Name: 4-[(4-chlorobenzoyl)-(1,1-dimethylprop-2-ynyl)amino]butyric acid Formula: C16H18ClNO3 MolecularWeight: 307.77202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#C)N(CCCC(=O)O)C(=O)C1=CC=C(C=C1)Cl

Isomeric SMILES

CC(C)(C#C)N(CCCC(=O)O)C(=O)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C16H18ClNO3/c1-4-16(2,3)18(11-5-6-14(19)20)15(21)12-7-9-13(17)10-8-12/h1,7-10H,5-6,11H2,2-3H3,(H,19,20)