1-[(5R)-9-[(4-propan-2-ylphenyl)methyl]-3-aza-9-azoniaspiro[4.5]decan-3-yl]but-2-yn-1-one

Systemtic Name: 1-[(5R)-9-[(4-propan-2-ylphenyl)methyl]-3-aza-9-azoniaspiro[4.5]decan-3-yl]but-2-yn-1-one Openeye Name: 1-[(5R)-9-[(4-isopropylphenyl)methyl]-3-aza-9-azoniaspiro[4.5]decan-3-yl]but-2-yn-1-one CAS Name: 1-[(5R)-9-[(4-propan-2-ylphenyl)methyl]-3-aza-9-azoniaspiro[4.5]decan-3-yl]-2-butyn-1-one IUPAC Name: 1-[(5R)-9-[(4-propan-2-ylphenyl)methyl]-3-aza-9-azoniaspiro[4.5]decan-3-yl]but-2-yn-1-one Traditional Name: 1-[(5R)-9-(4-isopropylbenzyl)-3-aza-9-azoniaspiro[4.5]decan-3-yl]but-2-yn-1-one Formula: C22H31N2O+ MolecularWeight: 339.49434

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC(=O)N1CCC2(C1)CCC[NH+](C2)CC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CC#CC(=O)N1CC[C@@]2(C1)CCC[NH+](C2)CC3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C22H30N2O/c1-4-6-21(25)24-14-12-22(17-24)11-5-13-23(16-22)15-19-7-9-20(10-8-19)18(2)3/h7-10,18H,5,11-17H2,1-3H3/p+1/t22-/m0/s1