benzotriazol-1-ylmethyl 2-(4-methylphenyl)quinoline-4-carboxylate

Systemtic Name: benzotriazol-1-ylmethyl 2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: benzotriazol-1-ylmethyl 2-(p-tolyl)quinoline-4-carboxylate CAS Name: 2-(4-methylphenyl)-4-quinolinecarboxylic acid 1-benzotriazolylmethyl ester IUPAC Name: benzotriazol-1-ylmethyl 2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 2-(p-tolyl)cinchoninic acid benzotriazol-1-ylmethyl ester Formula: C24H18N4O2 MolecularWeight: 394.42532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCN4C5=CC=CC=C5N=N4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C24H18N4O2/c1-16-10-12-17(13-11-16)22-14-19(18-6-2-3-7-20(18)25-22)24(29)30-15-28-23-9-5-4-8-21(23)26-27-28/h2-14H,15H2,1H3