2-cyclohexyl-N-[1-[(4-methylphenyl)amino]but-2-ynyl]-2-oxidanyl-2-phenyl-ethanamide hydrochloride

Systemtic Name: 2-cyclohexyl-N-[1-[(4-methylphenyl)amino]but-2-ynyl]-2-oxidanyl-2-phenyl-ethanamide hydrochloride Openeye Name: 2-cyclohexyl-2-hydroxy-N-[1-(4-methylanilino)but-2-ynyl]-2-phenyl-acetamide hydrochloride CAS Name: 2-cyclohexyl-2-hydroxy-N-[1-(4-methylanilino)but-2-ynyl]-2-phenylacetamide hydrochloride IUPAC Name: 2-cyclohexyl-2-hydroxy-N-[1-(4-methylanilino)but-2-ynyl]-2-phenylacetamide hydrochloride Traditional Name: 2-cyclohexyl-2-hydroxy-2-phenyl-N-[1-(p-toluidino)but-2-ynyl]acetamide hydrochloride Formula: C25H31ClN2O2 MolecularWeight: 426.97884

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC(NC1=CC=C(C=C1)C)NC(=O)C(C2CCCCC2)(C3=CC=CC=C3)O.Cl

Isomeric SMILES

CC#CC(NC1=CC=C(C=C1)C)NC(=O)C(C2CCCCC2)(C3=CC=CC=C3)O.Cl

InChI

InChI=1S/C25H30N2O2.ClH/c1-3-10-23(26-22-17-15-19(2)16-18-22)27-24(28)25(29,20-11-6-4-7-12-20)21-13-8-5-9-14-21;/h4,6-7,11-12,15-18,21,23,26,29H,5,8-9,13-14H2,1-2H3,(H,27,28);1H