(2R)-6-[(3,5-dimethoxyphenyl)methyl]-N-phenethyl-6-azoniaspiro[2.5]octane-2-carboxamide

Systemtic Name: (2R)-6-[(3,5-dimethoxyphenyl)methyl]-N-phenethyl-6-azoniaspiro[2.5]octane-2-carboxamide Openeye Name: (2R)-6-[(3,5-dimethoxyphenyl)methyl]-N-phenethyl-6-azoniaspiro[2.5]octane-2-carboxamide CAS Name: (2R)-6-[(3,5-dimethoxyphenyl)methyl]-N-phenethyl-6-azoniaspiro[2.5]octane-2-carboxamide IUPAC Name: (2R)-6-[(3,5-dimethoxyphenyl)methyl]-N-phenethyl-6-azoniaspiro[2.5]octane-2-carboxamide Traditional Name: (2R)-6-(3,5-dimethoxybenzyl)-N-phenethyl-6-azoniaspiro[2.5]octane-2-carboxamide Formula: C25H33N2O3+ MolecularWeight: 409.54112

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C[NH+]2CCC3(CC2)CC3C(=O)NCCC4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C[NH+]2CCC3(CC2)C[C@H]3C(=O)NCCC4=CC=CC=C4)OC

InChI

InChI=1S/C25H32N2O3/c1-29-21-14-20(15-22(16-21)30-2)18-27-12-9-25(10-13-27)17-23(25)24(28)26-11-8-19-6-4-3-5-7-19/h3-7,14-16,23H,8-13,17-18H2,1-2H3,(H,26,28)/p+1/t23-/m0/s1