(2R)-N-(2,6-dimethylphenyl)-2-[4-(4-ethoxyphenyl)carbonylpiperidin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-N-(2,6-dimethylphenyl)-2-[4-(4-ethoxyphenyl)carbonylpiperidin-1-ium-1-yl]propanamide Openeye Name: (2R)-N-(2,6-dimethylphenyl)-2-[4-(4-ethoxybenzoyl)piperidin-1-ium-1-yl]propanamide CAS Name: (2R)-N-(2,6-dimethylphenyl)-2-[4-[(4-ethoxyphenyl)-oxomethyl]-1-piperidin-1-iumyl]propanamide IUPAC Name: (2R)-N-(2,6-dimethylphenyl)-2-[4-(4-ethoxybenzoyl)piperidin-1-ium-1-yl]propanamide Traditional Name: (2R)-N-(2,6-dimethylphenyl)-2-[4-(4-ethoxybenzoyl)piperidin-1-ium-1-yl]propionamide Formula: C25H33N2O3+ MolecularWeight: 409.54112

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)C2CC[NH+](CC2)C(C)C(=O)NC3=C(C=CC=C3C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)C2CC[NH+](CC2)[C@H](C)C(=O)NC3=C(C=CC=C3C)C

InChI

InChI=1S/C25H32N2O3/c1-5-30-22-11-9-20(10-12-22)24(28)21-13-15-27(16-14-21)19(4)25(29)26-23-17(2)7-6-8-18(23)3/h6-12,19,21H,5,13-16H2,1-4H3,(H,26,29)/p+1/t19-/m1/s1