1-[(3S,5R)-5-phenyl-3-[(E)-2-phenylethenyl]-4,5-dihydro-3H-pyrazol-1-ium-1-yl]ethanone

Systemtic Name: 1-[(3S,5R)-5-phenyl-3-[(E)-2-phenylethenyl]-4,5-dihydro-3H-pyrazol-1-ium-1-yl]ethanone Openeye Name: 1-[(3S,5R)-5-phenyl-3-[(E)-styryl]-4,5-dihydro-3H-pyrazol-1-ium-1-yl]ethanone CAS Name: 1-[(3S,5R)-5-phenyl-3-[(E)-2-phenylethenyl]-4,5-dihydro-3H-pyrazol-1-ium-1-yl]ethanone IUPAC Name: 1-[(3S,5R)-5-phenyl-3-[(E)-2-phenylethenyl]-4,5-dihydro-3H-pyrazol-1-ium-1-yl]ethanone Traditional Name: 1-[(3S,5R)-5-phenyl-3-[(E)-styryl]-1-pyrazolin-1-ium-1-yl]ethanone Formula: C19H19N2O+ MolecularWeight: 291.36696

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[N+]1=NC(CC1C2=CC=CC=C2)C=CC3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C19H19N2O/c1-15(22)21-19(17-10-6-3-7-11-17)14-18(20-21)13-12-16-8-4-2-5-9-16/h2-13,18-19H,14H2,1H3/q+1/b13-12+/t18-,19-/m1/s1