(7-bromanyl-1-benzofuran-2-yl)-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (7-bromanyl-1-benzofuran-2-yl)-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (7-bromobenzofuran-2-yl)-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (7-bromo-2-benzofuranyl)-[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (7-bromo-1-benzofuran-2-yl)-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (7-bromobenzofuran-2-yl)-(4-p-phenetylsulfonylpiperazino)methanone Formula: C21H21BrN2O5S MolecularWeight: 493.37084

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=C(O3)C(=CC=C4)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=C(O3)C(=CC=C4)Br

InChI

InChI=1S/C21H21BrN2O5S/c1-2-28-16-6-8-17(9-7-16)30(26,27)24-12-10-23(11-13-24)21(25)19-14-15-4-3-5-18(22)20(15)29-19/h3-9,14H,2,10-13H2,1H3