[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(6-chloranyl-3,4-dihydro-2H-chromen-3-yl)methanone

Systemtic Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(6-chloranyl-3,4-dihydro-2H-chromen-3-yl)methanone Openeye Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(6-chlorochroman-3-yl)methanone CAS Name: [4-(4-bromophenyl)sulfonyl-1-piperazinyl]-(6-chloro-3,4-dihydro-2H-1-benzopyran-3-yl)methanone IUPAC Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(6-chloro-3,4-dihydro-2H-chromen-3-yl)methanone Traditional Name: (4-brosylpiperazino)-(6-chlorochroman-3-yl)methanone Formula: C20H20BrClN2O4S MolecularWeight: 499.8058

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2CC3=C(C=CC(=C3)Cl)OC2)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CN(CCN1C(=O)C2CC3=C(C=CC(=C3)Cl)OC2)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H20BrClN2O4S/c21-16-1-4-18(5-2-16)29(26,27)24-9-7-23(8-10-24)20(25)15-11-14-12-17(22)3-6-19(14)28-13-15/h1-6,12,15H,7-11,13H2