N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-1-methyl-4-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-quinoline-3-carboxamide

Systemtic Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-1-methyl-4-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-quinoline-3-carboxamide Openeye Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-1-methyl-4-oxo-6-pyrrolidin-1-ylsulfonyl-quinoline-3-carboxamide CAS Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-1-methyl-4-oxo-6-(1-pyrrolidinylsulfonyl)-3-quinolinecarboxamide IUPAC Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-1-methyl-4-oxo-6-pyrrolidin-1-ylsulfonylquinoline-3-carboxamide Traditional Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-keto-1-methyl-6-pyrrolidinosulfonyl-quinoline-3-carboxamide Formula: C25H27N3O6S MolecularWeight: 497.56338

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCO2)NC(=O)C3=CN(C4=C(C3=O)C=C(C=C4)S(=O)(=O)N5CCCC5)C

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCCO2)NC(=O)C3=CN(C4=C(C3=O)C=C(C=C4)S(=O)(=O)N5CCCC5)C

InChI

InChI=1S/C25H27N3O6S/c1-16(17-5-8-22-23(13-17)34-12-11-33-22)26-25(30)20-15-27(2)21-7-6-18(14-19(21)24(20)29)35(31,32)28-9-3-4-10-28/h5-8,13-16H,3-4,9-12H2,1-2H3,(H,26,30)