(5-cyclohexyl-5-oxidanyl-5-phenyl-pent-2-ynyl)-diethyl-azanium

Systemtic Name: (5-cyclohexyl-5-oxidanyl-5-phenyl-pent-2-ynyl)-diethyl-azanium Openeye Name: (5-cyclohexyl-5-hydroxy-5-phenyl-pent-2-ynyl)-diethyl-ammonium CAS Name: (5-cyclohexyl-5-hydroxy-5-phenylpent-2-ynyl)-diethylammonium IUPAC Name: (5-cyclohexyl-5-hydroxy-5-phenylpent-2-ynyl)-diethylazanium Traditional Name: (5-cyclohexyl-5-hydroxy-5-phenyl-pent-2-ynyl)-diethyl-ammonium Formula: C21H32NO+ MolecularWeight: 314.48488

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC#CCC(C1CCCCC1)(C2=CC=CC=C2)O

Isomeric SMILES

CC[NH+](CC)CC#CCC(C1CCCCC1)(C2=CC=CC=C2)O

InChI

InChI=1S/C21H31NO/c1-3-22(4-2)18-12-11-17-21(23,19-13-7-5-8-14-19)20-15-9-6-10-16-20/h5,7-8,13-14,20,23H,3-4,6,9-10,15-18H2,1-2H3/p+1