(E)-1-[(3R,4R)-1-ethyl-4-[(E)-2-(2-methylphenyl)ethenyl]-4-oxidanyl-piperidin-3-yl]-3-(2-methylphenyl)prop-2-en-1-one chloride

Systemtic Name: (E)-1-[(3R,4R)-1-ethyl-4-[(E)-2-(2-methylphenyl)ethenyl]-4-oxidanyl-piperidin-3-yl]-3-(2-methylphenyl)prop-2-en-1-one chloride Openeye Name: (E)-1-[(3R,4R)-1-ethyl-4-hydroxy-4-[(E)-2-(o-tolyl)vinyl]-3-piperidyl]-3-(o-tolyl)prop-2-en-1-one chloride CAS Name: (E)-1-[(3R,4R)-1-ethyl-4-hydroxy-4-[(E)-2-(2-methylphenyl)ethenyl]-3-piperidinyl]-3-(2-methylphenyl)-2-propen-1-one chloride IUPAC Name: (E)-1-[(3R,4R)-1-ethyl-4-hydroxy-4-[(E)-2-(2-methylphenyl)ethenyl]piperidin-3-yl]-3-(2-methylphenyl)prop-2-en-1-one chloride Traditional Name: (E)-1-[(3R,4R)-1-ethyl-4-hydroxy-4-[(E)-2-(o-tolyl)vinyl]-3-piperidyl]-3-(o-tolyl)prop-2-en-1-one chloride Formula: C26H31ClNO2- MolecularWeight: 424.98284

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(C(C1)C(=O)C=CC2=CC=CC=C2C)(C=CC3=CC=CC=C3C)O.[Cl-]

Isomeric SMILES

CCN1CC[C@]([C@@H](C1)C(=O)/C=C/C2=CC=CC=C2C)(/C=C/C3=CC=CC=C3C)O.[Cl-]

InChI

InChI=1S/C26H31NO2.ClH/c1-4-27-18-17-26(29,16-15-23-12-8-6-10-21(23)3)24(19-27)25(28)14-13-22-11-7-5-9-20(22)2;/h5-16,24,29H,4,17-19H2,1-3H3;1H/p-1/b14-13+,16-15+;/t24-,26-;/m0./s1