4-bromanyl-N-(4-methoxyphenyl)-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-bromanyl-N-(4-methoxyphenyl)-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: 4-bromo-N-(4-methoxyphenyl)-3-(1-piperidylsulfonyl)benzamide CAS Name: 4-bromo-N-(4-methoxyphenyl)-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: 4-bromo-N-(4-methoxyphenyl)-3-piperidin-1-ylsulfonylbenzamide Traditional Name: 4-bromo-N-(4-methoxyphenyl)-3-piperidinosulfonyl-benzamide Formula: C19H21BrN2O4S MolecularWeight: 453.35004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)Br)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)Br)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H21BrN2O4S/c1-26-16-8-6-15(7-9-16)21-19(23)14-5-10-17(20)18(13-14)27(24,25)22-11-3-2-4-12-22/h5-10,13H,2-4,11-12H2,1H3,(H,21,23)