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

Systemtic Name: 4-[(2-chlorophenyl)methylideneamino]-1,5-dimethyl-2-phenyl-4H-pyrazol-1-ium-3-one Openeye Name: 4-[(2-chlorophenyl)methyleneamino]-1,5-dimethyl-2-phenyl-4H-pyrazol-1-ium-3-one CAS Name: 4-[(2-chlorophenyl)methylideneamino]-1,5-dimethyl-2-phenyl-4H-pyrazol-1-ium-3-one IUPAC Name: 4-[(2-chlorophenyl)methylideneamino]-1,5-dimethyl-2-phenyl-4H-pyrazol-1-ium-3-one Traditional Name: 4-[(2-chlorobenzylidene)amino]-1,5-dimethyl-2-phenyl-2-pyrazolin-1-ium-3-one Formula: C18H17ClN3O+ MolecularWeight: 326.80008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](N(C(=O)C1N=CC2=CC=CC=C2Cl)C3=CC=CC=C3)C

Isomeric SMILES

CC1=[N+](N(C(=O)C1N=CC2=CC=CC=C2Cl)C3=CC=CC=C3)C

InChI

InChI=1S/C18H17ClN3O/c1-13-17(20-12-14-8-6-7-11-16(14)19)18(23)22(21(13)2)15-9-4-3-5-10-15/h3-12,17H,1-2H3/q+1