methyl 2-[(4-methylsulfonylphenyl)carbonyloxymethyl]-4-phenyl-quinoline-3-carboxylate

Systemtic Name: methyl 2-[(4-methylsulfonylphenyl)carbonyloxymethyl]-4-phenyl-quinoline-3-carboxylate Openeye Name: methyl 2-[(4-methylsulfonylbenzoyl)oxymethyl]-4-phenyl-quinoline-3-carboxylate CAS Name: 2-[[(4-methylsulfonylphenyl)-oxomethoxy]methyl]-4-phenyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(4-methylsulfonylbenzoyl)oxymethyl]-4-phenylquinoline-3-carboxylate Traditional Name: 2-[(4-mesylbenzoyl)oxymethyl]-4-phenyl-quinoline-3-carboxylic acid methyl ester Formula: C26H21NO6S MolecularWeight: 475.51304

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)C3=CC=C(C=C3)S(=O)(=O)C)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)C3=CC=C(C=C3)S(=O)(=O)C)C4=CC=CC=C4

InChI

InChI=1S/C26H21NO6S/c1-32-26(29)24-22(16-33-25(28)18-12-14-19(15-13-18)34(2,30)31)27-21-11-7-6-10-20(21)23(24)17-8-4-3-5-9-17/h3-15H,16H2,1-2H3