(2S)-N-ethyl-2-[4-(1,2,3,6-tetrahydropyridin-1-ium-4-yl)phenoxy]propanamide

Systemtic Name: (2S)-N-ethyl-2-[4-(1,2,3,6-tetrahydropyridin-1-ium-4-yl)phenoxy]propanamide Openeye Name: (2S)-N-ethyl-2-[4-(1,2,3,6-tetrahydropyridin-1-ium-4-yl)phenoxy]propanamide CAS Name: (2S)-N-ethyl-2-[4-(1,2,3,6-tetrahydropyridin-1-ium-4-yl)phenoxy]propanamide IUPAC Name: (2S)-N-ethyl-2-[4-(1,2,3,6-tetrahydropyridin-1-ium-4-yl)phenoxy]propanamide Traditional Name: (2S)-N-ethyl-2-[4-(1,2,3,6-tetrahydropyridin-1-ium-4-yl)phenoxy]propionamide Formula: C16H23N2O2+ MolecularWeight: 275.36602

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)OC1=CC=C(C=C1)C2=CC[NH2+]CC2

Isomeric SMILES

CCNC(=O)[C@H](C)OC1=CC=C(C=C1)C2=CC[NH2+]CC2

InChI

InChI=1S/C16H22N2O2/c1-3-18-16(19)12(2)20-15-6-4-13(5-7-15)14-8-10-17-11-9-14/h4-8,12,17H,3,9-11H2,1-2H3,(H,18,19)/p+1/t12-/m0/s1