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

Systemtic Name: (4S)-4-[[(E)-3-(2-methoxyphenyl)prop-2-enylidene]amino]-1,5-dimethyl-2-phenyl-4H-pyrazol-1-ium-3-one Openeye Name: (4S)-4-[[(E)-3-(2-methoxyphenyl)prop-2-enylidene]amino]-1,5-dimethyl-2-phenyl-4H-pyrazol-1-ium-3-one CAS Name: (4S)-4-[[(E)-3-(2-methoxyphenyl)prop-2-enylidene]amino]-1,5-dimethyl-2-phenyl-4H-pyrazol-1-ium-3-one IUPAC Name: (4S)-4-[[(E)-3-(2-methoxyphenyl)prop-2-enylidene]amino]-1,5-dimethyl-2-phenyl-4H-pyrazol-1-ium-3-one Traditional Name: (4S)-4-[[(E)-3-(2-methoxyphenyl)prop-2-enylidene]amino]-1,5-dimethyl-2-phenyl-2-pyrazolin-1-ium-3-one Formula: C21H22N3O2+ MolecularWeight: 348.41828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](N(C(=O)C1N=CC=CC2=CC=CC=C2OC)C3=CC=CC=C3)C

Isomeric SMILES

CC1=[N+](N(C(=O)[C@H]1N=C/C=C/C2=CC=CC=C2OC)C3=CC=CC=C3)C

InChI

InChI=1S/C21H22N3O2/c1-16-20(21(25)24(23(16)2)18-12-5-4-6-13-18)22-15-9-11-17-10-7-8-14-19(17)26-3/h4-15,20H,1-3H3/q+1/b11-9+,22-15?/t20-/m0/s1