3-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]carbonyl-1H-quinolin-2-one

Systemtic Name: 3-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]carbonyl-1H-quinolin-2-one Openeye Name: 3-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazine-1-carbonyl]-1H-quinolin-2-one CAS Name: 3-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1-piperazinyl]-oxomethyl]-1H-quinolin-2-one IUPAC Name: 3-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazine-1-carbonyl]-1H-quinolin-2-one Traditional Name: 3-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazine-1-carbonyl]carbostyril Formula: C22H21N3O6S MolecularWeight: 455.48364

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC3=CC=CC=C3NC2=O)S(=O)(=O)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC3=CC=CC=C3NC2=O)S(=O)(=O)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C22H21N3O6S/c26-21-17(13-15-3-1-2-4-18(15)23-21)22(27)24-7-9-25(10-8-24)32(28,29)16-5-6-19-20(14-16)31-12-11-30-19/h1-6,13-14H,7-12H2,(H,23,26)