(3R,6S)-6-(4,4-diphenylbut-3-enyl)piperidin-1-ium-3-carboxylic acid

Systemtic Name: (3R,6S)-6-(4,4-diphenylbut-3-enyl)piperidin-1-ium-3-carboxylic acid Openeye Name: (3R,6S)-6-(4,4-diphenylbut-3-enyl)piperidin-1-ium-3-carboxylic acid CAS Name: (3R,6S)-6-(4,4-diphenylbut-3-enyl)-3-piperidin-1-iumcarboxylic acid IUPAC Name: (3R,6S)-6-(4,4-diphenylbut-3-enyl)piperidin-1-ium-3-carboxylic acid Traditional Name: (3R,6S)-6-(4,4-diphenylbut-3-enyl)piperidin-1-ium-3-carboxylic acid Formula: C22H26NO2+ MolecularWeight: 336.44734

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH2+]CC1C(=O)O)CCC=C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C1C[C@@H]([NH2+]C[C@@H]1C(=O)O)CCC=C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H25NO2/c24-22(25)19-14-15-20(23-16-19)12-7-13-21(17-8-3-1-4-9-17)18-10-5-2-6-11-18/h1-6,8-11,13,19-20,23H,7,12,14-16H2,(H,24,25)/p+1/t19-,20+/m1/s1