6,8-bis(bromanyl)-3-[4-(phenylsulfonyl)piperazin-1-yl]carbonyl-chromen-2-one

Systemtic Name: 6,8-bis(bromanyl)-3-[4-(phenylsulfonyl)piperazin-1-yl]carbonyl-chromen-2-one Openeye Name: 3-[4-(benzenesulfonyl)piperazine-1-carbonyl]-6,8-dibromo-chromen-2-one CAS Name: 3-[[4-(benzenesulfonyl)-1-piperazinyl]-oxomethyl]-6,8-dibromo-1-benzopyran-2-one IUPAC Name: 3-[4-(benzenesulfonyl)piperazine-1-carbonyl]-6,8-dibromochromen-2-one Traditional Name: 3-(4-besylpiperazine-1-carbonyl)-6,8-dibromo-coumarin Formula: C20H16Br2N2O5S MolecularWeight: 556.22444

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC3=CC(=CC(=C3OC2=O)Br)Br)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC3=CC(=CC(=C3OC2=O)Br)Br)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H16Br2N2O5S/c21-14-10-13-11-16(20(26)29-18(13)17(22)12-14)19(25)23-6-8-24(9-7-23)30(27,28)15-4-2-1-3-5-15/h1-5,10-12H,6-9H2