(5S)-9-[(2,3-dimethoxyphenyl)methyl]-3-pentan-3-yl-9-aza-3-azoniaspiro[4.5]decan-10-one

Systemtic Name: (5S)-9-[(2,3-dimethoxyphenyl)methyl]-3-pentan-3-yl-9-aza-3-azoniaspiro[4.5]decan-10-one Openeye Name: (5S)-9-[(2,3-dimethoxyphenyl)methyl]-3-(1-ethylpropyl)-9-aza-3-azoniaspiro[4.5]decan-10-one CAS Name: (5S)-9-[(2,3-dimethoxyphenyl)methyl]-3-pentan-3-yl-9-aza-3-azoniaspiro[4.5]decan-10-one IUPAC Name: (5S)-9-[(2,3-dimethoxyphenyl)methyl]-3-pentan-3-yl-9-aza-3-azoniaspiro[4.5]decan-10-one Traditional Name: (5S)-3-(1-ethylpropyl)-9-o-veratryl-9-aza-3-azoniaspiro[4.5]decan-10-one Formula: C22H35N2O3+ MolecularWeight: 375.5249

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)[NH+]1CCC2(C1)CCCN(C2=O)CC3=C(C(=CC=C3)OC)OC

Isomeric SMILES

CCC(CC)[NH+]1CC[C@]2(C1)CCCN(C2=O)CC3=C(C(=CC=C3)OC)OC

InChI

InChI=1S/C22H34N2O3/c1-5-18(6-2)24-14-12-22(16-24)11-8-13-23(21(22)25)15-17-9-7-10-19(26-3)20(17)27-4/h7,9-10,18H,5-6,8,11-16H2,1-4H3/p+1/t22-/m0/s1