(6Z)-6-(1,2-dihydrobenzotriazol-4-ylidene)-2,4-bis(2-methylheptan-2-yl)cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-6-(1,2-dihydrobenzotriazol-4-ylidene)-2,4-bis(2-methylheptan-2-yl)cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-6-(1,2-dihydrobenzotriazol-4-ylidene)-2,4-bis(1,1-dimethylhexyl)cyclohexa-2,4-dien-1-one CAS Name: (6Z)-6-(1,2-dihydrobenzotriazol-4-ylidene)-2,4-bis(2-methylheptan-2-yl)-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-6-(1,2-dihydrobenzotriazol-4-ylidene)-2,4-bis(2-methylheptan-2-yl)cyclohexa-2,4-dien-1-one Traditional Name: (6Z)-6-(1,2-dihydrobenzotriazol-4-ylidene)-2,4-bis(1,1-dimethylhexyl)cyclohexa-2,4-dien-1-one Formula: C28H41N3O MolecularWeight: 435.64464

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C)C1=CC(=C2C=CC=C3C2=NNN3)C(=O)C(=C1)C(C)(C)CCCCC

Isomeric SMILES

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

InChI

InChI=1S/C28H41N3O/c1-7-9-11-16-27(3,4)20-18-22(21-14-13-15-24-25(21)30-31-29-24)26(32)23(19-20)28(5,6)17-12-10-8-2/h13-15,18-19,29,31H,7-12,16-17H2,1-6H3/b22-21-