(6Z)-6-(1,2-dihydrobenzotriazol-4-ylidene)-3-octoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-6-(1,2-dihydrobenzotriazol-4-ylidene)-3-octoxy-cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-6-(1,2-dihydrobenzotriazol-4-ylidene)-3-octoxy-cyclohexa-2,4-dien-1-one CAS Name: (6Z)-6-(1,2-dihydrobenzotriazol-4-ylidene)-3-octoxy-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-6-(1,2-dihydrobenzotriazol-4-ylidene)-3-octoxycyclohexa-2,4-dien-1-one Traditional Name: (6Z)-6-(1,2-dihydrobenzotriazol-4-ylidene)-3-octoxy-cyclohexa-2,4-dien-1-one Formula: C20H25N3O2 MolecularWeight: 339.4314

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC(=O)C(=C2C=CC=C3C2=NNN3)C=C1

Isomeric SMILES

CCCCCCCCOC1=CC(=O)/C(=C\2/C=CC=C3C2=NNN3)/C=C1

InChI

InChI=1S/C20H25N3O2/c1-2-3-4-5-6-7-13-25-15-11-12-16(19(24)14-15)17-9-8-10-18-20(17)22-23-21-18/h8-12,14,21,23H,2-7,13H2,1H3/b17-16-