3-[(3Z)-5-butyl-3-(1,2-dihydrobenzotriazol-4-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]oxypropyl 2-methylprop-2-enoate

Systemtic Name: 3-[(3Z)-5-butyl-3-(1,2-dihydrobenzotriazol-4-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]oxypropyl 2-methylprop-2-enoate Openeye Name: 3-[(3Z)-5-butyl-3-(1,2-dihydrobenzotriazol-4-ylidene)-4-oxo-cyclohexa-1,5-dien-1-yl]oxypropyl 2-methylprop-2-enoate CAS Name: 2-methyl-2-propenoic acid 3-[[(3Z)-5-butyl-3-(1,2-dihydrobenzotriazol-4-ylidene)-4-oxo-1-cyclohexa-1,5-dienyl]oxy]propyl ester IUPAC Name: 3-[(3Z)-5-butyl-3-(1,2-dihydrobenzotriazol-4-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]oxypropyl 2-methylprop-2-enoate Traditional Name: 2-methylacrylic acid 3-[(3Z)-5-butyl-3-(1,2-dihydrobenzotriazol-4-ylidene)-4-keto-cyclohexa-1,5-dien-1-yl]oxypropyl ester Formula: C23H27N3O4 MolecularWeight: 409.47818

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=CC(=C2C=CC=C3C2=NNN3)C1=O)OCCCOC(=O)C(=C)C

Isomeric SMILES

CCCCC1=CC(=C/C(=C/2\C=CC=C3C2=NNN3)/C1=O)OCCCOC(=O)C(=C)C

InChI

InChI=1S/C23H27N3O4/c1-4-5-8-16-13-17(29-11-7-12-30-23(28)15(2)3)14-19(22(16)27)18-9-6-10-20-21(18)25-26-24-20/h6,9-10,13-14,24,26H,2,4-5,7-8,11-12H2,1,3H3/b19-18-