2-[(5E)-5-(1,2-dihydrobenzotriazol-4-ylidene)-3-methyl-6-oxidanylidene-cyclohexa-1,3-dien-1-yl]ethyl 2-methylprop-2-enoate

Systemtic Name: 2-[(5E)-5-(1,2-dihydrobenzotriazol-4-ylidene)-3-methyl-6-oxidanylidene-cyclohexa-1,3-dien-1-yl]ethyl 2-methylprop-2-enoate Openeye Name: 2-[(5E)-5-(1,2-dihydrobenzotriazol-4-ylidene)-3-methyl-6-oxo-cyclohexa-1,3-dien-1-yl]ethyl 2-methylprop-2-enoate CAS Name: 2-methyl-2-propenoic acid 2-[(5E)-5-(1,2-dihydrobenzotriazol-4-ylidene)-3-methyl-6-oxo-1-cyclohexa-1,3-dienyl]ethyl ester IUPAC Name: 2-[(5E)-5-(1,2-dihydrobenzotriazol-4-ylidene)-3-methyl-6-oxocyclohexa-1,3-dien-1-yl]ethyl 2-methylprop-2-enoate Traditional Name: 2-methylacrylic acid 2-[(5E)-5-(1,2-dihydrobenzotriazol-4-ylidene)-6-keto-3-methyl-cyclohexa-1,3-dien-1-yl]ethyl ester Formula: C19H19N3O3 MolecularWeight: 337.37246

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19N3O3/c1-11(2)19(24)25-8-7-13-9-12(3)10-15(18(13)23)14-5-4-6-16-17(14)21-22-20-16/h4-6,9-10,20,22H,1,7-8H2,2-3H3/b15-14+