(2-bromanyl-5-methoxy-phenyl)-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (2-bromanyl-5-methoxy-phenyl)-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (2-bromo-5-methoxy-phenyl)-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (2-bromo-5-methoxyphenyl)-[4-(4-fluorophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (2-bromo-5-methoxyphenyl)-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (2-bromo-5-methoxy-phenyl)-[4-(4-fluorophenyl)sulfonylpiperazino]methanone Formula: C18H18BrFN2O4S MolecularWeight: 457.313923

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC(=C(C=C1)Br)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H18BrFN2O4S/c1-26-14-4-7-17(19)16(12-14)18(23)21-8-10-22(11-9-21)27(24,25)15-5-2-13(20)3-6-15/h2-7,12H,8-11H2,1H3