methyl 3-(phenylsulfonylaminomethyl)-1-(2-propan-2-ylsulfonylpropyl)indole-5-carboxylate

Systemtic Name: methyl 3-(phenylsulfonylaminomethyl)-1-(2-propan-2-ylsulfonylpropyl)indole-5-carboxylate Openeye Name: methyl 3-(benzenesulfonamidomethyl)-1-(2-isopropylsulfonylpropyl)indole-5-carboxylate CAS Name: 3-(benzenesulfonamidomethyl)-1-(2-propan-2-ylsulfonylpropyl)-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 3-(benzenesulfonamidomethyl)-1-(2-propan-2-ylsulfonylpropyl)indole-5-carboxylate Traditional Name: 3-(benzenesulfonamidomethyl)-1-(2-isopropylsulfonylpropyl)indole-5-carboxylic acid methyl ester Formula: C23H28N2O6S2 MolecularWeight: 492.60822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C(C)CN1C=C(C2=C1C=CC(=C2)C(=O)OC)CNS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)S(=O)(=O)C(C)CN1C=C(C2=C1C=CC(=C2)C(=O)OC)CNS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H28N2O6S2/c1-16(2)32(27,28)17(3)14-25-15-19(13-24-33(29,30)20-8-6-5-7-9-20)21-12-18(23(26)31-4)10-11-22(21)25/h5-12,15-17,24H,13-14H2,1-4H3