phenacyl 8-methyl-2-(4-propan-2-ylphenyl)quinoline-4-carboxylate

Systemtic Name: phenacyl 8-methyl-2-(4-propan-2-ylphenyl)quinoline-4-carboxylate Openeye Name: phenacyl 2-(4-isopropylphenyl)-8-methyl-quinoline-4-carboxylate CAS Name: 8-methyl-2-(4-propan-2-ylphenyl)-4-quinolinecarboxylic acid phenacyl ester IUPAC Name: phenacyl 8-methyl-2-(4-propan-2-ylphenyl)quinoline-4-carboxylate Traditional Name: 8-methyl-2-p-cumenyl-cinchoninic acid phenacyl ester Formula: C28H25NO3 MolecularWeight: 423.503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C(=O)OCC(=O)C3=CC=CC=C3)C4=CC=C(C=C4)C(C)C

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C(=O)OCC(=O)C3=CC=CC=C3)C4=CC=C(C=C4)C(C)C

InChI

InChI=1S/C28H25NO3/c1-18(2)20-12-14-21(15-13-20)25-16-24(23-11-7-8-19(3)27(23)29-25)28(31)32-17-26(30)22-9-5-4-6-10-22/h4-16,18H,17H2,1-3H3