3-bromanyl-2,5-dimethoxy-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]benzamide

Systemtic Name: 3-bromanyl-2,5-dimethoxy-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]benzamide Openeye Name: 3-bromo-2,5-dimethoxy-N-[[2-(1-piperidylsulfonyl)phenyl]methyl]benzamide CAS Name: 3-bromo-2,5-dimethoxy-N-[[2-(1-piperidinylsulfonyl)phenyl]methyl]benzamide IUPAC Name: 3-bromo-2,5-dimethoxy-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]benzamide Traditional Name: 3-bromo-2,5-dimethoxy-N-(2-piperidinosulfonylbenzyl)benzamide Formula: C21H25BrN2O5S MolecularWeight: 497.4026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)C(=O)NCC2=CC=CC=C2S(=O)(=O)N3CCCCC3)OC)Br

Isomeric SMILES

COC1=CC(=C(C(=C1)C(=O)NCC2=CC=CC=C2S(=O)(=O)N3CCCCC3)OC)Br

InChI

InChI=1S/C21H25BrN2O5S/c1-28-16-12-17(20(29-2)18(22)13-16)21(25)23-14-15-8-4-5-9-19(15)30(26,27)24-10-6-3-7-11-24/h4-5,8-9,12-13H,3,6-7,10-11,14H2,1-2H3,(H,23,25)