methyl 2-[[2-(phenylsulfinyl)-3-(phenylsulfonyl)indol-1-yl]methyl]benzoate

Systemtic Name: methyl 2-[[2-(phenylsulfinyl)-3-(phenylsulfonyl)indol-1-yl]methyl]benzoate Openeye Name: methyl 2-[[2-(benzenesulfinyl)-3-(benzenesulfonyl)indol-1-yl]methyl]benzoate CAS Name: 2-[[2-(benzenesulfinyl)-3-(benzenesulfonyl)-1-indolyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(benzenesulfinyl)-3-(benzenesulfonyl)indol-1-yl]methyl]benzoate Traditional Name: 2-[[2-(benzenesulfinyl)-3-besyl-indol-1-yl]methyl]benzoic acid methyl ester Formula: C29H23NO5S2 MolecularWeight: 529.62662

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1CN2C3=CC=CC=C3C(=C2S(=O)C4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=CC=CC=C1CN2C3=CC=CC=C3C(=C2S(=O)C4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C29H23NO5S2/c1-35-29(31)24-17-9-8-12-21(24)20-30-26-19-11-10-18-25(26)27(37(33,34)23-15-6-3-7-16-23)28(30)36(32)22-13-4-2-5-14-22/h2-19H,20H2,1H3