4-[[(E)-(3-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]amino]-1,5-dimethyl-2-phenyl-4H-pyrazol-1-ium-3-one

Systemtic Name: 4-[[(E)-(3-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]amino]-1,5-dimethyl-2-phenyl-4H-pyrazol-1-ium-3-one Openeye Name: 4-[[(E)-(3-ethoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]amino]-1,5-dimethyl-2-phenyl-4H-pyrazol-1-ium-3-one CAS Name: 4-[[(E)-(3-ethoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]amino]-1,5-dimethyl-2-phenyl-4H-pyrazol-1-ium-3-one IUPAC Name: 4-[[(E)-(3-ethoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]amino]-1,5-dimethyl-2-phenyl-4H-pyrazol-1-ium-3-one Traditional Name: 4-[[(E)-(3-ethoxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methyl]amino]-1,5-dimethyl-2-phenyl-2-pyrazolin-1-ium-3-one Formula: C20H22N3O3+ MolecularWeight: 352.40698

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CNC2C(=[N+](N(C2=O)C3=CC=CC=C3)C)C)C=CC1=O

Isomeric SMILES

CCOC1=C/C(=C/NC2C(=[N+](N(C2=O)C3=CC=CC=C3)C)C)/C=CC1=O

InChI

InChI=1S/C20H21N3O3/c1-4-26-18-12-15(10-11-17(18)24)13-21-19-14(2)22(3)23(20(19)25)16-8-6-5-7-9-16/h5-13,19H,4H2,1-3H3/p+1