(6Z)-6-[4-(4-tert-butylphenoxy)-1,2-dihydropyrazol-3-ylidene]-3-propoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-6-[4-(4-tert-butylphenoxy)-1,2-dihydropyrazol-3-ylidene]-3-propoxy-cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-6-[4-(4-tert-butylphenoxy)-1,2-dihydropyrazol-3-ylidene]-3-propoxy-cyclohexa-2,4-dien-1-one CAS Name: (6Z)-6-[4-(4-tert-butylphenoxy)-1,2-dihydropyrazol-3-ylidene]-3-propoxy-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-6-[4-(4-tert-butylphenoxy)-1,2-dihydropyrazol-3-ylidene]-3-propoxycyclohexa-2,4-dien-1-one Traditional Name: (6Z)-6-[4-(4-tert-butylphenoxy)-3-pyrazolin-3-ylidene]-3-propoxy-cyclohexa-2,4-dien-1-one Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=O)C(=C2C(=CNN2)OC3=CC=C(C=C3)C(C)(C)C)C=C1

Isomeric SMILES

CCCOC1=CC(=O)/C(=C\2/C(=CNN2)OC3=CC=C(C=C3)C(C)(C)C)/C=C1

InChI

InChI=1S/C22H26N2O3/c1-5-12-26-17-10-11-18(19(25)13-17)21-20(14-23-24-21)27-16-8-6-15(7-9-16)22(2,3)4/h6-11,13-14,23-24H,5,12H2,1-4H3/b21-18-