(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-(3-chlorophenyl)-3-methyl-quinoline-4-carboxylate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-(3-chlorophenyl)-3-methyl-quinoline-4-carboxylate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-(3-chlorophenyl)-3-methyl-quinoline-4-carboxylate CAS Name: 2-(3-chlorophenyl)-3-methyl-4-quinolinecarboxylic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-(3-chlorophenyl)-3-methylquinoline-4-carboxylate Traditional Name: 2-(3-chlorophenyl)-3-methyl-cinchoninic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C25H17ClN4O3 MolecularWeight: 456.88048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N=C1C3=CC(=CC=C3)Cl)C(=O)OCN4C(=O)C5=CC=CC=C5N=N4

Isomeric SMILES

CC1=C(C2=CC=CC=C2N=C1C3=CC(=CC=C3)Cl)C(=O)OCN4C(=O)C5=CC=CC=C5N=N4

InChI

InChI=1S/C25H17ClN4O3/c1-15-22(25(32)33-14-30-24(31)19-10-3-5-12-21(19)28-29-30)18-9-2-4-11-20(18)27-23(15)16-7-6-8-17(26)13-16/h2-13H,14H2,1H3