8-[(3Z)-3-(1,2-dihydrobenzotriazol-4-ylidene)-5-methyl-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]octyl prop-2-enoate

Systemtic Name: 8-[(3Z)-3-(1,2-dihydrobenzotriazol-4-ylidene)-5-methyl-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]octyl prop-2-enoate Openeye Name: 8-[(3Z)-3-(1,2-dihydrobenzotriazol-4-ylidene)-5-methyl-4-oxo-cyclohexa-1,5-dien-1-yl]octyl prop-2-enoate CAS Name: 2-propenoic acid 8-[(3Z)-3-(1,2-dihydrobenzotriazol-4-ylidene)-5-methyl-4-oxo-1-cyclohexa-1,5-dienyl]octyl ester IUPAC Name: 8-[(3Z)-3-(1,2-dihydrobenzotriazol-4-ylidene)-5-methyl-4-oxocyclohexa-1,5-dien-1-yl]octyl prop-2-enoate Traditional Name: acrylic acid 8-[(3Z)-3-(1,2-dihydrobenzotriazol-4-ylidene)-4-keto-5-methyl-cyclohexa-1,5-dien-1-yl]octyl ester Formula: C24H29N3O3 MolecularWeight: 407.50536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C2C=CC=C3C2=NNN3)C1=O)CCCCCCCCOC(=O)C=C

Isomeric SMILES

CC1=CC(=C/C(=C/2\C=CC=C3C2=NNN3)/C1=O)CCCCCCCCOC(=O)C=C

InChI

InChI=1S/C24H29N3O3/c1-3-22(28)30-14-9-7-5-4-6-8-11-18-15-17(2)24(29)20(16-18)19-12-10-13-21-23(19)26-27-25-21/h3,10,12-13,15-16,25,27H,1,4-9,11,14H2,2H3/b20-19-