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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H30N2O2.ClH/c1-27(23-17-9-4-10-18-23)20-12-11-19-26-24(28)25(29,21-13-5-2-6-14-21)22-15-7-3-8-16-22;/h2,4-6,9-10,13-14,17-18,22,29H,3,7-8,15-16,19-20H2,1H3,(H,26,28);1H