(2R)-6-[(3-ethoxy-4-methoxy-phenyl)methyl]-N-phenethyl-6-azoniaspiro[2.5]octane-2-carboxamide

Systemtic Name: (2R)-6-[(3-ethoxy-4-methoxy-phenyl)methyl]-N-phenethyl-6-azoniaspiro[2.5]octane-2-carboxamide Openeye Name: (2R)-6-[(3-ethoxy-4-methoxy-phenyl)methyl]-N-phenethyl-6-azoniaspiro[2.5]octane-2-carboxamide CAS Name: (2R)-6-[(3-ethoxy-4-methoxyphenyl)methyl]-N-phenethyl-6-azoniaspiro[2.5]octane-2-carboxamide IUPAC Name: (2R)-6-[(3-ethoxy-4-methoxyphenyl)methyl]-N-phenethyl-6-azoniaspiro[2.5]octane-2-carboxamide Traditional Name: (2R)-6-(3-ethoxy-4-methoxy-benzyl)-N-phenethyl-6-azoniaspiro[2.5]octane-2-carboxamide Formula: C26H35N2O3+ MolecularWeight: 423.5677

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH+]2CCC3(CC2)CC3C(=O)NCCC4=CC=CC=C4)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH+]2CCC3(CC2)C[C@H]3C(=O)NCCC4=CC=CC=C4)OC

InChI

InChI=1S/C26H34N2O3/c1-3-31-24-17-21(9-10-23(24)30-2)19-28-15-12-26(13-16-28)18-22(26)25(29)27-14-11-20-7-5-4-6-8-20/h4-10,17,22H,3,11-16,18-19H2,1-2H3,(H,27,29)/p+1/t22-/m0/s1