4-[(E)-3-[(2R)-2-ethylpiperidin-1-ium-1-yl]prop-1-enyl]-N,N-dimethyl-aniline

Systemtic Name: 4-[(E)-3-[(2R)-2-ethylpiperidin-1-ium-1-yl]prop-1-enyl]-N,N-dimethyl-aniline Openeye Name: 4-[(E)-3-[(2R)-2-ethylpiperidin-1-ium-1-yl]prop-1-enyl]-N,N-dimethyl-aniline CAS Name: 4-[(E)-3-[(2R)-2-ethyl-1-piperidin-1-iumyl]prop-1-enyl]-N,N-dimethylaniline IUPAC Name: 4-[(E)-3-[(2R)-2-ethylpiperidin-1-ium-1-yl]prop-1-enyl]-N,N-dimethylaniline Traditional Name: [4-[(E)-3-[(2R)-2-ethylpiperidin-1-ium-1-yl]prop-1-enyl]phenyl]-dimethyl-amine Formula: C18H29N2+ MolecularWeight: 273.43626

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CC=CC2=CC=C(C=C2)N(C)C

Isomeric SMILES

CC[C@@H]1CCCC[NH+]1C/C=C/C2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C18H28N2/c1-4-17-9-5-6-14-20(17)15-7-8-16-10-12-18(13-11-16)19(2)3/h7-8,10-13,17H,4-6,9,14-15H2,1-3H3/p+1/b8-7+/t17-/m1/s1