methyl 1-[2-(2-hydroxyphenyl)-2-propan-2-ylsulfonyl-ethyl]-3-[(phenoxysulfonylamino)methyl]indole-5-carboxylate

Systemtic Name: methyl 1-[2-(2-hydroxyphenyl)-2-propan-2-ylsulfonyl-ethyl]-3-[(phenoxysulfonylamino)methyl]indole-5-carboxylate Openeye Name: methyl 1-[2-(2-hydroxyphenyl)-2-isopropylsulfonyl-ethyl]-3-[(phenoxysulfonylamino)methyl]indole-5-carboxylate CAS Name: 1-[2-(2-hydroxyphenyl)-2-propan-2-ylsulfonylethyl]-3-[(phenoxysulfonylamino)methyl]-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(2-hydroxyphenyl)-2-propan-2-ylsulfonylethyl]-3-[(phenoxysulfonylamino)methyl]indole-5-carboxylate Traditional Name: 1-[2-(2-hydroxyphenyl)-2-isopropylsulfonyl-ethyl]-3-[(phenoxysulfonylamino)methyl]indole-5-carboxylic acid methyl ester Formula: C28H30N2O8S2 MolecularWeight: 586.6764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C(CN1C=C(C2=C1C=CC(=C2)C(=O)OC)CNS(=O)(=O)OC3=CC=CC=C3)C4=CC=CC=C4O

Isomeric SMILES

CC(C)S(=O)(=O)C(CN1C=C(C2=C1C=CC(=C2)C(=O)OC)CNS(=O)(=O)OC3=CC=CC=C3)C4=CC=CC=C4O

InChI

InChI=1S/C28H30N2O8S2/c1-19(2)39(33,34)27(23-11-7-8-12-26(23)31)18-30-17-21(24-15-20(28(32)37-3)13-14-25(24)30)16-29-40(35,36)38-22-9-5-4-6-10-22/h4-15,17,19,27,29,31H,16,18H2,1-3H3