(3-bromanyl-4-methoxy-phenyl)-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (3-bromanyl-4-methoxy-phenyl)-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (3-bromo-4-methoxy-phenyl)-[4-(p-tolylsulfonyl)piperazin-1-yl]methanone CAS Name: (3-bromo-4-methoxyphenyl)-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (3-bromo-4-methoxyphenyl)-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (3-bromo-4-methoxy-phenyl)-(4-tosylpiperazino)methanone Formula: C19H21BrN2O4S MolecularWeight: 453.35004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)OC)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)OC)Br

InChI

InChI=1S/C19H21BrN2O4S/c1-14-3-6-16(7-4-14)27(24,25)22-11-9-21(10-12-22)19(23)15-5-8-18(26-2)17(20)13-15/h3-8,13H,9-12H2,1-2H3