4-[[(3E)-4-ethyl-6-oxidanylidene-3-(3-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-1,2-diazinan-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[(3E)-4-ethyl-6-oxidanylidene-3-(3-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-1,2-diazinan-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[(3E)-4-ethyl-3-(3-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-6-oxo-hexahydropyridazin-1-yl]methyl]benzonitrile CAS Name: 4-[[(3E)-4-ethyl-3-(3-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)-6-oxo-1-diazinanyl]methyl]benzonitrile IUPAC Name: 4-[[(3E)-4-ethyl-3-(3-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)-6-oxodiazinan-1-yl]methyl]benzonitrile Traditional Name: 4-[[(3E)-4-ethyl-3-(3-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)-6-keto-hexahydropyridazin-1-yl]methyl]benzonitrile Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC(=O)N(NC1=C2C=CC(=O)C(=C2)O)CC3=CC=C(C=C3)C#N

Isomeric SMILES

CCC\1CC(=O)N(N/C1=C/2\C=CC(=O)C(=C2)O)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H19N3O3/c1-2-15-10-19(26)23(12-14-5-3-13(11-21)4-6-14)22-20(15)16-7-8-17(24)18(25)9-16/h3-9,15,22,25H,2,10,12H2,1H3/b20-16+