2-[6-(hydroxymethyl)-1-methyl-indol-3-yl]-2-(7-methoxy-1,3-benzodioxol-5-yl)-N-(2-methoxy-4-methyl-phenyl)sulfonyl-ethanamide

Systemtic Name: 2-[6-(hydroxymethyl)-1-methyl-indol-3-yl]-2-(7-methoxy-1,3-benzodioxol-5-yl)-N-(2-methoxy-4-methyl-phenyl)sulfonyl-ethanamide Openeye Name: 2-[6-(hydroxymethyl)-1-methyl-indol-3-yl]-2-(7-methoxy-1,3-benzodioxol-5-yl)-N-(2-methoxy-4-methyl-phenyl)sulfonyl-acetamide CAS Name: 2-[6-(hydroxymethyl)-1-methyl-3-indolyl]-2-(7-methoxy-1,3-benzodioxol-5-yl)-N-(2-methoxy-4-methylphenyl)sulfonylacetamide IUPAC Name: 2-[6-(hydroxymethyl)-1-methylindol-3-yl]-2-(7-methoxy-1,3-benzodioxol-5-yl)-N-(2-methoxy-4-methylphenyl)sulfonylacetamide Traditional Name: 2-(7-methoxy-1,3-benzodioxol-5-yl)-N-(2-methoxy-4-methyl-phenyl)sulfonyl-2-(1-methyl-6-methylol-indol-3-yl)acetamide Formula: C28H28N2O8S MolecularWeight: 552.59552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)NC(=O)C(C2=CC3=C(C(=C2)OC)OCO3)C4=CN(C5=C4C=CC(=C5)CO)C)OC

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)NC(=O)C(C2=CC3=C(C(=C2)OC)OCO3)C4=CN(C5=C4C=CC(=C5)CO)C)OC

InChI

InChI=1S/C28H28N2O8S/c1-16-5-8-25(22(9-16)35-3)39(33,34)29-28(32)26(18-11-23(36-4)27-24(12-18)37-15-38-27)20-13-30(2)21-10-17(14-31)6-7-19(20)21/h5-13,26,31H,14-15H2,1-4H3,(H,29,32)