4-[2-cyclobutyl-3-(4-hydroxyphenyl)-4-iodanyl-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[2-cyclobutyl-3-(4-hydroxyphenyl)-4-iodanyl-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[2-cyclobutyl-3-(4-hydroxyphenyl)-4-iodo-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[2-cyclobutyl-3-(4-hydroxyphenyl)-4-iodo-1H-pyrazol-5-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[2-cyclobutyl-3-(4-hydroxyphenyl)-4-iodo-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[1-cyclobutyl-5-(4-hydroxyphenyl)-4-iodo-3-pyrazolin-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C19H17IN2O2 MolecularWeight: 432.25495

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)N2C(=C(C(=C3C=CC(=O)C=C3)N2)I)C4=CC=C(C=C4)O

Isomeric SMILES

C1CC(C1)N2C(=C(C(=C3C=CC(=O)C=C3)N2)I)C4=CC=C(C=C4)O

InChI

InChI=1S/C19H17IN2O2/c20-17-18(12-4-8-15(23)9-5-12)21-22(14-2-1-3-14)19(17)13-6-10-16(24)11-7-13/h4-11,14,21,24H,1-3H2