N-[(5-bromanyl-2-methoxy-phenyl)methyl]-1-morpholin-4-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[(5-bromanyl-2-methoxy-phenyl)methyl]-1-morpholin-4-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[(5-bromo-2-methoxy-phenyl)methyl]-1-morpholinosulfonyl-piperidine-3-carboxamide CAS Name: N-[(5-bromo-2-methoxyphenyl)methyl]-1-(4-morpholinylsulfonyl)-3-piperidinecarboxamide IUPAC Name: N-[(5-bromo-2-methoxyphenyl)methyl]-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-(5-bromo-2-methoxy-benzyl)-1-morpholinosulfonyl-nipecotamide Formula: C18H26BrN3O5S MolecularWeight: 476.38514

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)CNC(=O)C2CCCN(C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)CNC(=O)C2CCCN(C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H26BrN3O5S/c1-26-17-5-4-16(19)11-15(17)12-20-18(23)14-3-2-6-22(13-14)28(24,25)21-7-9-27-10-8-21/h4-5,11,14H,2-3,6-10,12-13H2,1H3,(H,20,23)