(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl (E)-3-quinolin-2-ylprop-2-enoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl (E)-3-quinolin-2-ylprop-2-enoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl (E)-3-(2-quinolyl)prop-2-enoate CAS Name: (E)-3-(2-quinolinyl)-2-propenoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl (E)-3-quinolin-2-ylprop-2-enoate Traditional Name: (E)-3-(2-quinolyl)acrylic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C20H14N4O3 MolecularWeight: 358.35016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C=CC(=O)OCN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)/C=C/C(=O)OCN3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C20H14N4O3/c25-19(12-11-15-10-9-14-5-1-3-7-17(14)21-15)27-13-24-20(26)16-6-2-4-8-18(16)22-23-24/h1-12H,13H2/b12-11+