methyl 4-phenyl-1-(phenylsulfonyl)indole-3-carboxylate

Systemtic Name: methyl 4-phenyl-1-(phenylsulfonyl)indole-3-carboxylate Openeye Name: methyl 1-(benzenesulfonyl)-4-phenyl-indole-3-carboxylate CAS Name: 1-(benzenesulfonyl)-4-phenyl-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-(benzenesulfonyl)-4-phenylindole-3-carboxylate Traditional Name: 1-besyl-4-phenyl-indole-3-carboxylic acid methyl ester Formula: C22H17NO4S MolecularWeight: 391.43968

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C2=CC=CC(=C21)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CN(C2=CC=CC(=C21)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H17NO4S/c1-27-22(24)19-15-23(28(25,26)17-11-6-3-7-12-17)20-14-8-13-18(21(19)20)16-9-4-2-5-10-16/h2-15H,1H3