(4S)-1,5-dimethyl-2-phenyl-4-[[(E)-3-phenylprop-2-enylidene]amino]-4H-pyrazol-1-ium-3-one

Systemtic Name: (4S)-1,5-dimethyl-2-phenyl-4-[[(E)-3-phenylprop-2-enylidene]amino]-4H-pyrazol-1-ium-3-one Openeye Name: (4S)-1,5-dimethyl-2-phenyl-4-[[(E)-3-phenylprop-2-enylidene]amino]-4H-pyrazol-1-ium-3-one CAS Name: (4S)-1,5-dimethyl-2-phenyl-4-[[(E)-3-phenylprop-2-enylidene]amino]-4H-pyrazol-1-ium-3-one IUPAC Name: (4S)-1,5-dimethyl-2-phenyl-4-[[(E)-3-phenylprop-2-enylidene]amino]-4H-pyrazol-1-ium-3-one Traditional Name: (4S)-1,5-dimethyl-2-phenyl-4-[[(E)-3-phenylprop-2-enylidene]amino]-2-pyrazolin-1-ium-3-one Formula: C20H20N3O+ MolecularWeight: 318.3923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](N(C(=O)C1N=CC=CC2=CC=CC=C2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=[N+](N(C(=O)[C@H]1N=C/C=C/C2=CC=CC=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C20H20N3O/c1-16-19(21-15-9-12-17-10-5-3-6-11-17)20(24)23(22(16)2)18-13-7-4-8-14-18/h3-15,19H,1-2H3/q+1/b12-9+,21-15?/t19-/m0/s1