(E)-1-[(3R,4R)-1-ethyl-1-methyl-4-oxidanyl-4-[(E)-2-phenylethenyl]piperidin-1-ium-3-yl]-3-phenyl-prop-2-en-1-one

Systemtic Name: (E)-1-[(3R,4R)-1-ethyl-1-methyl-4-oxidanyl-4-[(E)-2-phenylethenyl]piperidin-1-ium-3-yl]-3-phenyl-prop-2-en-1-one Openeye Name: (E)-1-[(3R,4R)-1-ethyl-4-hydroxy-1-methyl-4-[(E)-styryl]piperidin-1-ium-3-yl]-3-phenyl-prop-2-en-1-one CAS Name: (E)-1-[(3R,4R)-1-ethyl-4-hydroxy-1-methyl-4-[(E)-2-phenylethenyl]-3-piperidin-1-iumyl]-3-phenyl-2-propen-1-one IUPAC Name: (E)-1-[(3R,4R)-1-ethyl-4-hydroxy-1-methyl-4-[(E)-2-phenylethenyl]piperidin-1-ium-3-yl]-3-phenylprop-2-en-1-one Traditional Name: (E)-1-[(3R,4R)-1-ethyl-4-hydroxy-1-methyl-4-[(E)-styryl]piperidin-1-ium-3-yl]-3-phenyl-prop-2-en-1-one Formula: C25H30NO2+ MolecularWeight: 376.5112

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(CCC(C(C1)C(=O)C=CC2=CC=CC=C2)(C=CC3=CC=CC=C3)O)C

Isomeric SMILES

CC[N+]1(CC[C@]([C@@H](C1)C(=O)/C=C/C2=CC=CC=C2)(/C=C/C3=CC=CC=C3)O)C

InChI

InChI=1S/C25H30NO2/c1-3-26(2)19-18-25(28,17-16-22-12-8-5-9-13-22)23(20-26)24(27)15-14-21-10-6-4-7-11-21/h4-17,23,28H,3,18-20H2,1-2H3/q+1/b15-14+,17-16+/t23-,25-,26?/m0/s1