[(3E)-3-(1,2-dihydrobenzotriazol-4-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl] prop-2-enoate

Systemtic Name: [(3E)-3-(1,2-dihydrobenzotriazol-4-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl] prop-2-enoate Openeye Name: [(3E)-3-(1,2-dihydrobenzotriazol-4-ylidene)-4-oxo-cyclohexa-1,5-dien-1-yl] prop-2-enoate CAS Name: 2-propenoic acid [(3E)-3-(1,2-dihydrobenzotriazol-4-ylidene)-4-oxo-1-cyclohexa-1,5-dienyl] ester IUPAC Name: [(3E)-3-(1,2-dihydrobenzotriazol-4-ylidene)-4-oxocyclohexa-1,5-dien-1-yl] prop-2-enoate Traditional Name: acrylic acid [(3E)-3-(1,2-dihydrobenzotriazol-4-ylidene)-4-keto-cyclohexa-1,5-dien-1-yl] ester Formula: C15H11N3O3 MolecularWeight: 281.26614

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)OC1=CC(=C2C=CC=C3C2=NNN3)C(=O)C=C1

Isomeric SMILES

C=CC(=O)OC1=C/C(=C\2/C=CC=C3C2=NNN3)/C(=O)C=C1

InChI

InChI=1S/C15H11N3O3/c1-2-14(20)21-9-6-7-13(19)11(8-9)10-4-3-5-12-15(10)17-18-16-12/h2-8,16,18H,1H2/b11-10+