ethyl 4-[(4-chlorophenyl)carbonyl-(2-methylbut-3-yn-2-yl)amino]butanoate

Systemtic Name: ethyl 4-[(4-chlorophenyl)carbonyl-(2-methylbut-3-yn-2-yl)amino]butanoate Openeye Name: ethyl 4-[(4-chlorobenzoyl)-(1,1-dimethylprop-2-ynyl)amino]butanoate CAS Name: 4-[[(4-chlorophenyl)-oxomethyl]-(2-methylbut-3-yn-2-yl)amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[(4-chlorobenzoyl)-(2-methylbut-3-yn-2-yl)amino]butanoate Traditional Name: 4-[(4-chlorobenzoyl)-(1,1-dimethylprop-2-ynyl)amino]butyric acid ethyl ester Formula: C18H22ClNO3 MolecularWeight: 335.82518

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN(C(=O)C1=CC=C(C=C1)Cl)C(C)(C)C#C

Isomeric SMILES

CCOC(=O)CCCN(C(=O)C1=CC=C(C=C1)Cl)C(C)(C)C#C

InChI

InChI=1S/C18H22ClNO3/c1-5-18(3,4)20(13-7-8-16(21)23-6-2)17(22)14-9-11-15(19)12-10-14/h1,9-12H,6-8,13H2,2-4H3