3-[(5-bromanyl-1-ethanoyl-2,3-dihydroindol-7-yl)sulfonyl]-N-(2-ethylhexyl)propanamide

Systemtic Name: 3-[(5-bromanyl-1-ethanoyl-2,3-dihydroindol-7-yl)sulfonyl]-N-(2-ethylhexyl)propanamide Openeye Name: 3-(1-acetyl-5-bromo-indolin-7-yl)sulfonyl-N-(2-ethylhexyl)propanamide CAS Name: 3-[(1-acetyl-5-bromo-2,3-dihydroindol-7-yl)sulfonyl]-N-(2-ethylhexyl)propanamide IUPAC Name: 3-[(1-acetyl-5-bromo-2,3-dihydroindol-7-yl)sulfonyl]-N-(2-ethylhexyl)propanamide Traditional Name: 3-(1-acetyl-5-bromo-indolin-7-yl)sulfonyl-N-(2-ethylhexyl)propionamide Formula: C21H31BrN2O4S MolecularWeight: 487.45084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)CCS(=O)(=O)C1=C2C(=CC(=C1)Br)CCN2C(=O)C

Isomeric SMILES

CCCCC(CC)CNC(=O)CCS(=O)(=O)C1=C2C(=CC(=C1)Br)CCN2C(=O)C

InChI

InChI=1S/C21H31BrN2O4S/c1-4-6-7-16(5-2)14-23-20(26)9-11-29(27,28)19-13-18(22)12-17-8-10-24(15(3)25)21(17)19/h12-13,16H,4-11,14H2,1-3H3,(H,23,26)