phenacyl 6-bromanyl-2-(3-methoxyphenyl)-8-methyl-quinoline-4-carboxylate

Systemtic Name: phenacyl 6-bromanyl-2-(3-methoxyphenyl)-8-methyl-quinoline-4-carboxylate Openeye Name: phenacyl 6-bromo-2-(3-methoxyphenyl)-8-methyl-quinoline-4-carboxylate CAS Name: 6-bromo-2-(3-methoxyphenyl)-8-methyl-4-quinolinecarboxylic acid phenacyl ester IUPAC Name: phenacyl 6-bromo-2-(3-methoxyphenyl)-8-methylquinoline-4-carboxylate Traditional Name: 6-bromo-2-(3-methoxyphenyl)-8-methyl-cinchoninic acid phenacyl ester Formula: C26H20BrNO4 MolecularWeight: 490.3453

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)Br)C(=CC(=N2)C3=CC(=CC=C3)OC)C(=O)OCC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=CC(=C1)Br)C(=CC(=N2)C3=CC(=CC=C3)OC)C(=O)OCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H20BrNO4/c1-16-11-19(27)13-21-22(26(30)32-15-24(29)17-7-4-3-5-8-17)14-23(28-25(16)21)18-9-6-10-20(12-18)31-2/h3-14H,15H2,1-2H3