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

Systemtic Name: 1,5-dimethyl-2-phenyl-4-[(2,4,5-trimethoxyphenyl)methylideneamino]-4H-pyrazol-1-ium-3-one Openeye Name: 1,5-dimethyl-2-phenyl-4-[(2,4,5-trimethoxyphenyl)methyleneamino]-4H-pyrazol-1-ium-3-one CAS Name: 1,5-dimethyl-2-phenyl-4-[(2,4,5-trimethoxyphenyl)methylideneamino]-4H-pyrazol-1-ium-3-one IUPAC Name: 1,5-dimethyl-2-phenyl-4-[(2,4,5-trimethoxyphenyl)methylideneamino]-4H-pyrazol-1-ium-3-one Traditional Name: 1,5-dimethyl-2-phenyl-4-[(2,4,5-trimethoxybenzylidene)amino]-2-pyrazolin-1-ium-3-one Formula: C21H24N3O4+ MolecularWeight: 382.43296

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N3O4/c1-14-20(21(25)24(23(14)2)16-9-7-6-8-10-16)22-13-15-11-18(27-4)19(28-5)12-17(15)26-3/h6-13,20H,1-5H3/q+1