methyl 1-[2-(2-hydroxyphenyl)butyl]-3-[(phenoxysulfonylamino)methyl]indole-5-carboxylate

Systemtic Name: methyl 1-[2-(2-hydroxyphenyl)butyl]-3-[(phenoxysulfonylamino)methyl]indole-5-carboxylate Openeye Name: methyl 1-[2-(2-hydroxyphenyl)butyl]-3-[(phenoxysulfonylamino)methyl]indole-5-carboxylate CAS Name: 1-[2-(2-hydroxyphenyl)butyl]-3-[(phenoxysulfonylamino)methyl]-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(2-hydroxyphenyl)butyl]-3-[(phenoxysulfonylamino)methyl]indole-5-carboxylate Traditional Name: 1-[2-(2-hydroxyphenyl)butyl]-3-[(phenoxysulfonylamino)methyl]indole-5-carboxylic acid methyl ester Formula: C27H28N2O6S MolecularWeight: 508.58602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H28N2O6S/c1-3-19(23-11-7-8-12-26(23)30)17-29-18-21(24-15-20(27(31)34-2)13-14-25(24)29)16-28-36(32,33)35-22-9-5-4-6-10-22/h4-15,18-19,28,30H,3,16-17H2,1-2H3