1-[(5-bromanyl-1-propanoyl-2,3-dihydroindol-7-yl)sulfonyl]-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperidine-3-carboxamide

Systemtic Name: 1-[(5-bromanyl-1-propanoyl-2,3-dihydroindol-7-yl)sulfonyl]-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperidine-3-carboxamide Openeye Name: 1-(5-bromo-1-propanoyl-indolin-7-yl)sulfonyl-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperidine-3-carboxamide CAS Name: 1-[[5-bromo-1-(1-oxopropyl)-2,3-dihydroindol-7-yl]sulfonyl]-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-piperidinecarboxamide IUPAC Name: 1-[(5-bromo-1-propanoyl-2,3-dihydroindol-7-yl)sulfonyl]-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperidine-3-carboxamide Traditional Name: 1-(5-bromo-1-propionyl-indolin-7-yl)sulfonyl-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)nipecotamide Formula: C26H30BrN3O6S MolecularWeight: 592.5019

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=CC(=CC(=C21)S(=O)(=O)N3CCCC(C3)C(=O)NCC4COC5=CC=CC=C5O4)Br

Isomeric SMILES

CCC(=O)N1CCC2=CC(=CC(=C21)S(=O)(=O)N3CCCC(C3)C(=O)NCC4COC5=CC=CC=C5O4)Br

InChI

InChI=1S/C26H30BrN3O6S/c1-2-24(31)30-11-9-17-12-19(27)13-23(25(17)30)37(33,34)29-10-5-6-18(15-29)26(32)28-14-20-16-35-21-7-3-4-8-22(21)36-20/h3-4,7-8,12-13,18,20H,2,5-6,9-11,14-16H2,1H3,(H,28,32)