[2-(benzotriazol-2-yl)-4-methyl-phenyl] 2-phenylquinoline-4-carboxylate

Systemtic Name: [2-(benzotriazol-2-yl)-4-methyl-phenyl] 2-phenylquinoline-4-carboxylate Openeye Name: [2-(benzotriazol-2-yl)-4-methyl-phenyl] 2-phenylquinoline-4-carboxylate CAS Name: 2-phenyl-4-quinolinecarboxylic acid [2-(2-benzotriazolyl)-4-methylphenyl] ester IUPAC Name: [2-(benzotriazol-2-yl)-4-methylphenyl] 2-phenylquinoline-4-carboxylate Traditional Name: 2-phenylcinchoninic acid [2-(benzotriazol-2-yl)-4-methyl-phenyl] ester Formula: C29H20N4O2 MolecularWeight: 456.4947

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4)N5N=C6C=CC=CC6=N5

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4)N5N=C6C=CC=CC6=N5

InChI

InChI=1S/C29H20N4O2/c1-19-15-16-28(27(17-19)33-31-24-13-7-8-14-25(24)32-33)35-29(34)22-18-26(20-9-3-2-4-10-20)30-23-12-6-5-11-21(22)23/h2-18H,1H3