(3S,6S)-N-[2-(4-methoxyphenyl)ethyl]-6-methyl-piperidin-1-ium-3-carboxamide

Systemtic Name: (3S,6S)-N-[2-(4-methoxyphenyl)ethyl]-6-methyl-piperidin-1-ium-3-carboxamide Openeye Name: (3S,6S)-N-[2-(4-methoxyphenyl)ethyl]-6-methyl-piperidin-1-ium-3-carboxamide CAS Name: (3S,6S)-N-[2-(4-methoxyphenyl)ethyl]-6-methyl-3-piperidin-1-iumcarboxamide IUPAC Name: (3S,6S)-N-[2-(4-methoxyphenyl)ethyl]-6-methylpiperidin-1-ium-3-carboxamide Traditional Name: (3S,6S)-N-[2-(4-methoxyphenyl)ethyl]-6-methyl-piperidin-1-ium-3-carboxamide Formula: C16H25N2O2+ MolecularWeight: 277.3819

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C[NH2+]1)C(=O)NCCC2=CC=C(C=C2)OC

Isomeric SMILES

C[C@H]1CC[C@@H](C[NH2+]1)C(=O)NCCC2=CC=C(C=C2)OC

InChI

InChI=1S/C16H24N2O2/c1-12-3-6-14(11-18-12)16(19)17-10-9-13-4-7-15(20-2)8-5-13/h4-5,7-8,12,14,18H,3,6,9-11H2,1-2H3,(H,17,19)/p+1/t12-,14-/m0/s1