3-(3-bromanylphenoxy)-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]propanamide

Systemtic Name: 3-(3-bromanylphenoxy)-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]propanamide Openeye Name: 3-(3-bromophenoxy)-N-[[4-(1-piperidylsulfonyl)phenyl]methyl]propanamide CAS Name: 3-(3-bromophenoxy)-N-[[4-(1-piperidinylsulfonyl)phenyl]methyl]propanamide IUPAC Name: 3-(3-bromophenoxy)-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]propanamide Traditional Name: 3-(3-bromophenoxy)-N-(4-piperidinosulfonylbenzyl)propionamide Formula: C21H25BrN2O4S MolecularWeight: 481.4032

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CNC(=O)CCOC3=CC(=CC=C3)Br

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CNC(=O)CCOC3=CC(=CC=C3)Br

InChI

InChI=1S/C21H25BrN2O4S/c22-18-5-4-6-19(15-18)28-14-11-21(25)23-16-17-7-9-20(10-8-17)29(26,27)24-12-2-1-3-13-24/h4-10,15H,1-3,11-14,16H2,(H,23,25)