6-chloranyl-4-methyl-7-[2-oxidanylidene-2-[4-(phenylsulfonyl)piperazin-1-yl]ethoxy]chromen-2-one

Systemtic Name: 6-chloranyl-4-methyl-7-[2-oxidanylidene-2-[4-(phenylsulfonyl)piperazin-1-yl]ethoxy]chromen-2-one Openeye Name: 7-[2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxo-ethoxy]-6-chloro-4-methyl-chromen-2-one CAS Name: 7-[2-[4-(benzenesulfonyl)-1-piperazinyl]-2-oxoethoxy]-6-chloro-4-methyl-1-benzopyran-2-one IUPAC Name: 7-[2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxoethoxy]-6-chloro-4-methylchromen-2-one Traditional Name: 7-[2-(4-besylpiperazino)-2-keto-ethoxy]-6-chloro-4-methyl-coumarin Formula: C22H21ClN2O6S MolecularWeight: 476.92994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H21ClN2O6S/c1-15-11-22(27)31-19-13-20(18(23)12-17(15)19)30-14-21(26)24-7-9-25(10-8-24)32(28,29)16-5-3-2-4-6-16/h2-6,11-13H,7-10,14H2,1H3