N-[(5-bromanyl-2-methoxy-phenyl)methyl]-1-ethylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(5-bromanyl-2-methoxy-phenyl)methyl]-1-ethylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[(5-bromo-2-methoxy-phenyl)methyl]-1-ethylsulfonyl-piperidine-4-carboxamide CAS Name: N-[(5-bromo-2-methoxyphenyl)methyl]-1-ethylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(5-bromo-2-methoxyphenyl)methyl]-1-ethylsulfonylpiperidine-4-carboxamide Traditional Name: N-(5-bromo-2-methoxy-benzyl)-1-esyl-isonipecotamide Formula: C16H23BrN2O4S MolecularWeight: 419.33382

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)C(=O)NCC2=C(C=CC(=C2)Br)OC

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)C(=O)NCC2=C(C=CC(=C2)Br)OC

InChI

InChI=1S/C16H23BrN2O4S/c1-3-24(21,22)19-8-6-12(7-9-19)16(20)18-11-13-10-14(17)4-5-15(13)23-2/h4-5,10,12H,3,6-9,11H2,1-2H3,(H,18,20)