4-[(4-ethoxyphenyl)methylideneamino]-1,5-dimethyl-2-phenyl-4H-pyrazol-1-ium-3-one

Systemtic Name: 4-[(4-ethoxyphenyl)methylideneamino]-1,5-dimethyl-2-phenyl-4H-pyrazol-1-ium-3-one Openeye Name: 4-[(4-ethoxyphenyl)methyleneamino]-1,5-dimethyl-2-phenyl-4H-pyrazol-1-ium-3-one CAS Name: 4-[(4-ethoxyphenyl)methylideneamino]-1,5-dimethyl-2-phenyl-4H-pyrazol-1-ium-3-one IUPAC Name: 4-[(4-ethoxyphenyl)methylideneamino]-1,5-dimethyl-2-phenyl-4H-pyrazol-1-ium-3-one Traditional Name: 4-[(4-ethoxybenzylidene)amino]-1,5-dimethyl-2-phenyl-2-pyrazolin-1-ium-3-one Formula: C20H22N3O2+ MolecularWeight: 336.40758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=NC2C(=[N+](N(C2=O)C3=CC=CC=C3)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C=NC2C(=[N+](N(C2=O)C3=CC=CC=C3)C)C

InChI

InChI=1S/C20H22N3O2/c1-4-25-18-12-10-16(11-13-18)14-21-19-15(2)22(3)23(20(19)24)17-8-6-5-7-9-17/h5-14,19H,4H2,1-3H3/q+1