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

Systemtic Name: 1-[(5R)-9-[(4-propan-2-ylphenyl)methyl]-3-aza-9-azoniaspiro[4.5]decan-3-yl]but-3-en-1-one Openeye Name: 1-[(5R)-9-[(4-isopropylphenyl)methyl]-3-aza-9-azoniaspiro[4.5]decan-3-yl]but-3-en-1-one CAS Name: 1-[(5R)-9-[(4-propan-2-ylphenyl)methyl]-3-aza-9-azoniaspiro[4.5]decan-3-yl]-3-buten-1-one IUPAC Name: 1-[(5R)-9-[(4-propan-2-ylphenyl)methyl]-3-aza-9-azoniaspiro[4.5]decan-3-yl]but-3-en-1-one Traditional Name: 1-[(5R)-9-(4-isopropylbenzyl)-3-aza-9-azoniaspiro[4.5]decan-3-yl]but-3-en-1-one Formula: C22H33N2O+ MolecularWeight: 341.51022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C[NH+]2CCCC3(C2)CCN(C3)C(=O)CC=C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C[NH+]2CCC[C@@]3(C2)CCN(C3)C(=O)CC=C

InChI

InChI=1S/C22H32N2O/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/h4,7-10,18H,1,5-6,11-17H2,2-3H3/p+1/t22-/m0/s1