3-[(1-phenylpyrazol-4-yl)methoxy]-6-[4-(4-propylphenoxy)-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 3-[(1-phenylpyrazol-4-yl)methoxy]-6-[4-(4-propylphenoxy)-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 3-[(1-phenylpyrazol-4-yl)methoxy]-6-[4-(4-propylphenoxy)-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 3-[(1-phenyl-4-pyrazolyl)methoxy]-6-[4-(4-propylphenoxy)-1,2-dihydropyrazol-3-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 3-[(1-phenylpyrazol-4-yl)methoxy]-6-[4-(4-propylphenoxy)-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 3-[(1-phenylpyrazol-4-yl)methoxy]-6-[4-(4-propylphenoxy)-3-pyrazolin-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C28H26N4O3 MolecularWeight: 466.53104

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OC2=CNNC2=C3C=CC(=CC3=O)OCC4=CN(N=C4)C5=CC=CC=C5

Isomeric SMILES

CCCC1=CC=C(C=C1)OC2=CNNC2=C3C=CC(=CC3=O)OCC4=CN(N=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H26N4O3/c1-2-6-20-9-11-23(12-10-20)35-27-17-29-31-28(27)25-14-13-24(15-26(25)33)34-19-21-16-30-32(18-21)22-7-4-3-5-8-22/h3-5,7-18,29,31H,2,6,19H2,1H3