7-[2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethoxy]-4-methyl-chromen-2-one

Systemtic Name: 7-[2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethoxy]-4-methyl-chromen-2-one Openeye Name: 7-[2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-2-oxo-ethoxy]-4-methyl-chromen-2-one CAS Name: 7-[2-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-2-oxoethoxy]-4-methyl-1-benzopyran-2-one IUPAC Name: 7-[2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-2-oxoethoxy]-4-methylchromen-2-one Traditional Name: 7-[2-[4-(4-chlorophenyl)sulfonylpiperazino]-2-keto-ethoxy]-4-methyl-coumarin Formula: C22H21ClN2O6S MolecularWeight: 476.92994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

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