ethyl 4-[(4-chlorophenyl)carbonyl-(1-ethynylcyclohexyl)amino]butanoate

Systemtic Name: ethyl 4-[(4-chlorophenyl)carbonyl-(1-ethynylcyclohexyl)amino]butanoate Openeye Name: ethyl 4-[(4-chlorobenzoyl)-(1-ethynylcyclohexyl)amino]butanoate CAS Name: 4-[[(4-chlorophenyl)-oxomethyl]-(1-ethynylcyclohexyl)amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[(4-chlorobenzoyl)-(1-ethynylcyclohexyl)amino]butanoate Traditional Name: 4-[(4-chlorobenzoyl)-(1-ethynylcyclohexyl)amino]butyric acid ethyl ester Formula: C21H26ClNO3 MolecularWeight: 375.88904

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN(C(=O)C1=CC=C(C=C1)Cl)C2(CCCCC2)C#C

Isomeric SMILES

CCOC(=O)CCCN(C(=O)C1=CC=C(C=C1)Cl)C2(CCCCC2)C#C

InChI

InChI=1S/C21H26ClNO3/c1-3-21(14-6-5-7-15-21)23(16-8-9-19(24)26-4-2)20(25)17-10-12-18(22)13-11-17/h1,10-13H,4-9,14-16H2,2H3