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

Systemtic Name: 2-cyclohexyl-N-[4-[ethyl-(phenylmethyl)amino]but-2-ynyl]-2-oxidanyl-2-phenyl-ethanamide hydrochloride Openeye Name: N-[4-[benzyl(ethyl)amino]but-2-ynyl]-2-cyclohexyl-2-hydroxy-2-phenyl-acetamide hydrochloride CAS Name: 2-cyclohexyl-N-[4-[ethyl-(phenylmethyl)amino]but-2-ynyl]-2-hydroxy-2-phenylacetamide hydrochloride IUPAC Name: N-[4-[benzyl(ethyl)amino]but-2-ynyl]-2-cyclohexyl-2-hydroxy-2-phenylacetamide hydrochloride Traditional Name: N-[4-[benzyl(ethyl)amino]but-2-ynyl]-2-cyclohexyl-2-hydroxy-2-phenyl-acetamide hydrochloride Formula: C27H35ClN2O2 MolecularWeight: 455.032

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC#CCNC(=O)C(C1CCCCC1)(C2=CC=CC=C2)O)CC3=CC=CC=C3.Cl

Isomeric SMILES

CCN(CC#CCNC(=O)C(C1CCCCC1)(C2=CC=CC=C2)O)CC3=CC=CC=C3.Cl

InChI

InChI=1S/C27H34N2O2.ClH/c1-2-29(22-23-14-6-3-7-15-23)21-13-12-20-28-26(30)27(31,24-16-8-4-9-17-24)25-18-10-5-11-19-25;/h3-4,6-9,14-17,25,31H,2,5,10-11,18-22H2,1H3,(H,28,30);1H