6-[4-(3,4-dihydro-2H-1,5-benzodioxepin-6-yl)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[4-(3,4-dihydro-2H-1,5-benzodioxepin-6-yl)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[4-(3,4-dihydro-2H-1,5-benzodioxepin-6-yl)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[4-(3,4-dihydro-2H-1,5-benzodioxepin-6-yl)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[4-(3,4-dihydro-2H-1,5-benzodioxepin-6-yl)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[4-(3,4-dihydro-2H-1,5-benzodioxepin-6-yl)-5-methyl-3-pyrazolin-3-ylidene]-3-methoxy-cyclohexa-2,4-dien-1-one Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C=CC(=CC2=O)OC)NN1)C3=C4C(=CC=C3)OCCCO4

Isomeric SMILES

CC1=C(C(=C2C=CC(=CC2=O)OC)NN1)C3=C4C(=CC=C3)OCCCO4

InChI

InChI=1S/C20H20N2O4/c1-12-18(15-5-3-6-17-20(15)26-10-4-9-25-17)19(22-21-12)14-8-7-13(24-2)11-16(14)23/h3,5-8,11,21-22H,4,9-10H2,1-2H3