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

Systemtic Name: naphthalen-1-ylmethyl 2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: 1-naphthylmethyl 2-(p-tolyl)quinoline-4-carboxylate CAS Name: 2-(4-methylphenyl)-4-quinolinecarboxylic acid 1-naphthalenylmethyl ester IUPAC Name: naphthalen-1-ylmethyl 2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 2-(p-tolyl)cinchoninic acid 1-naphthylmethyl ester Formula: C28H21NO2 MolecularWeight: 403.47184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C28H21NO2/c1-19-13-15-21(16-14-19)27-17-25(24-11-4-5-12-26(24)29-27)28(30)31-18-22-9-6-8-20-7-2-3-10-23(20)22/h2-17H,18H2,1H3