3-(2-morpholin-4-ium-4-ylethoxy)-6-(4-phenyl-1,2-dihydropyrazol-3-ylidene)cyclohexa-2,4-dien-1-one

Systemtic Name: 3-(2-morpholin-4-ium-4-ylethoxy)-6-(4-phenyl-1,2-dihydropyrazol-3-ylidene)cyclohexa-2,4-dien-1-one Openeye Name: 3-(2-morpholin-4-ium-4-ylethoxy)-6-(4-phenyl-1,2-dihydropyrazol-3-ylidene)cyclohexa-2,4-dien-1-one CAS Name: 3-[2-(4-morpholin-4-iumyl)ethoxy]-6-(4-phenyl-1,2-dihydropyrazol-3-ylidene)-1-cyclohexa-2,4-dienone IUPAC Name: 3-(2-morpholin-4-ium-4-ylethoxy)-6-(4-phenyl-1,2-dihydropyrazol-3-ylidene)cyclohexa-2,4-dien-1-one Traditional Name: 3-(2-morpholin-4-ium-4-ylethoxy)-6-(4-phenyl-3-pyrazolin-3-ylidene)cyclohexa-2,4-dien-1-one Formula: C21H24N3O3+ MolecularWeight: 366.43356

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCOC2=CC(=O)C(=C3C(=CNN3)C4=CC=CC=C4)C=C2

Isomeric SMILES

C1COCC[NH+]1CCOC2=CC(=O)C(=C3C(=CNN3)C4=CC=CC=C4)C=C2

InChI

InChI=1S/C21H23N3O3/c25-20-14-17(27-13-10-24-8-11-26-12-9-24)6-7-18(20)21-19(15-22-23-21)16-4-2-1-3-5-16/h1-7,14-15,22-23H,8-13H2/p+1