[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-(2,3-dihydro-1-benzofuran-5-yl)methanone

Systemtic Name: [4-(3-bromophenyl)sulfonylpiperazin-1-yl]-(2,3-dihydro-1-benzofuran-5-yl)methanone Openeye Name: [4-(3-bromophenyl)sulfonylpiperazin-1-yl]-(2,3-dihydrobenzofuran-5-yl)methanone CAS Name: [4-(3-bromophenyl)sulfonyl-1-piperazinyl]-(2,3-dihydrobenzofuran-5-yl)methanone IUPAC Name: [4-(3-bromophenyl)sulfonylpiperazin-1-yl]-(2,3-dihydro-1-benzofuran-5-yl)methanone Traditional Name: [4-(3-bromophenyl)sulfonylpiperazino]-coumaran-5-yl-methanone Formula: C19H19BrN2O4S MolecularWeight: 451.33416

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

C1COC2=C1C=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C19H19BrN2O4S/c20-16-2-1-3-17(13-16)27(24,25)22-9-7-21(8-10-22)19(23)15-4-5-18-14(12-15)6-11-26-18/h1-5,12-13H,6-11H2