6-[4-(4-methoxyphenyl)-1,2-dihydropyrazol-3-ylidene]-2-methyl-3-(2-morpholin-4-ium-4-ylethoxy)cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[4-(4-methoxyphenyl)-1,2-dihydropyrazol-3-ylidene]-2-methyl-3-(2-morpholin-4-ium-4-ylethoxy)cyclohexa-2,4-dien-1-one Openeye Name: 6-[4-(4-methoxyphenyl)-1,2-dihydropyrazol-3-ylidene]-2-methyl-3-(2-morpholin-4-ium-4-ylethoxy)cyclohexa-2,4-dien-1-one CAS Name: 6-[4-(4-methoxyphenyl)-1,2-dihydropyrazol-3-ylidene]-2-methyl-3-[2-(4-morpholin-4-iumyl)ethoxy]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[4-(4-methoxyphenyl)-1,2-dihydropyrazol-3-ylidene]-2-methyl-3-(2-morpholin-4-ium-4-ylethoxy)cyclohexa-2,4-dien-1-one Traditional Name: 6-[4-(4-methoxyphenyl)-3-pyrazolin-3-ylidene]-2-methyl-3-(2-morpholin-4-ium-4-ylethoxy)cyclohexa-2,4-dien-1-one Formula: C23H28N3O4+ MolecularWeight: 410.48612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C2C(=CNN2)C3=CC=C(C=C3)OC)C1=O)OCC[NH+]4CCOCC4

Isomeric SMILES

CC1=C(C=CC(=C2C(=CNN2)C3=CC=C(C=C3)OC)C1=O)OCC[NH+]4CCOCC4

InChI

InChI=1S/C23H27N3O4/c1-16-21(30-14-11-26-9-12-29-13-10-26)8-7-19(23(16)27)22-20(15-24-25-22)17-3-5-18(28-2)6-4-17/h3-8,15,24-25H,9-14H2,1-2H3/p+1