N-(2-bromanyl-4-methyl-phenyl)-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-3-(1-piperidylsulfonyl)benzamide CAS Name: N-(2-bromo-4-methylphenyl)-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(2-bromo-4-methylphenyl)-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-3-piperidinosulfonyl-benzamide Formula: C19H21BrN2O3S MolecularWeight: 437.35064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)Br

InChI

InChI=1S/C19H21BrN2O3S/c1-14-8-9-18(17(20)12-14)21-19(23)15-6-5-7-16(13-15)26(24,25)22-10-3-2-4-11-22/h5-9,12-13H,2-4,10-11H2,1H3,(H,21,23)