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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-(2-ethyl-4-methyl-phenyl)sulfonyl-2-[6-(hydroxymethyl)-1-methyl-indol-3-yl]ethanamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-(2-ethyl-4-methyl-phenyl)sulfonyl-2-[6-(hydroxymethyl)-1-methyl-indol-3-yl]acetamide CAS Name: 2-(1,3-benzodioxol-5-yl)-N-(2-ethyl-4-methylphenyl)sulfonyl-2-[6-(hydroxymethyl)-1-methyl-3-indolyl]acetamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-(2-ethyl-4-methylphenyl)sulfonyl-2-[6-(hydroxymethyl)-1-methylindol-3-yl]acetamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-N-(2-ethyl-4-methyl-phenyl)sulfonyl-2-(1-methyl-6-methylol-indol-3-yl)acetamide Formula: C28H28N2O6S MolecularWeight: 520.59672

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)C)S(=O)(=O)NC(=O)C(C2=CC3=C(C=C2)OCO3)C4=CN(C5=C4C=CC(=C5)CO)C

Isomeric SMILES

CCC1=C(C=CC(=C1)C)S(=O)(=O)NC(=O)C(C2=CC3=C(C=C2)OCO3)C4=CN(C5=C4C=CC(=C5)CO)C

InChI

InChI=1S/C28H28N2O6S/c1-4-19-11-17(2)5-10-26(19)37(33,34)29-28(32)27(20-7-9-24-25(13-20)36-16-35-24)22-14-30(3)23-12-18(15-31)6-8-21(22)23/h5-14,27,31H,4,15-16H2,1-3H3,(H,29,32)