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

Systemtic Name: 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]chromen-2-one CAS Name: 7-[2-[4-(benzenesulfonyl)-1-piperazinyl]-2-oxoethoxy]-1-benzopyran-2-one IUPAC Name: 7-[2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxoethoxy]chromen-2-one Traditional Name: 7-[2-(4-besylpiperazino)-2-keto-ethoxy]coumarin Formula: C21H20N2O6S MolecularWeight: 428.4583

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)COC2=CC3=C(C=C2)C=CC(=O)O3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)COC2=CC3=C(C=C2)C=CC(=O)O3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H20N2O6S/c24-20(15-28-17-8-6-16-7-9-21(25)29-19(16)14-17)22-10-12-23(13-11-22)30(26,27)18-4-2-1-3-5-18/h1-9,14H,10-13,15H2