(2R)-6-[(2,4-dimethylphenyl)methyl]-N-phenethyl-6-azoniaspiro[2.5]octane-2-carboxamide

Systemtic Name: (2R)-6-[(2,4-dimethylphenyl)methyl]-N-phenethyl-6-azoniaspiro[2.5]octane-2-carboxamide Openeye Name: (2R)-6-[(2,4-dimethylphenyl)methyl]-N-phenethyl-6-azoniaspiro[2.5]octane-2-carboxamide CAS Name: (2R)-6-[(2,4-dimethylphenyl)methyl]-N-phenethyl-6-azoniaspiro[2.5]octane-2-carboxamide IUPAC Name: (2R)-6-[(2,4-dimethylphenyl)methyl]-N-phenethyl-6-azoniaspiro[2.5]octane-2-carboxamide Traditional Name: (2R)-6-(2,4-dimethylbenzyl)-N-phenethyl-6-azoniaspiro[2.5]octane-2-carboxamide Formula: C25H33N2O+ MolecularWeight: 377.54232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C[NH+]2CCC3(CC2)CC3C(=O)NCCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)C[NH+]2CCC3(CC2)C[C@H]3C(=O)NCCC4=CC=CC=C4)C

InChI

InChI=1S/C25H32N2O/c1-19-8-9-22(20(2)16-19)18-27-14-11-25(12-15-27)17-23(25)24(28)26-13-10-21-6-4-3-5-7-21/h3-9,16,23H,10-15,17-18H2,1-2H3,(H,26,28)/p+1/t23-/m0/s1