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

Systemtic Name: 1-[(4-bromophenyl)methyl]-N-(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)piperidine-3-carboxamide Openeye Name: 1-[(4-bromophenyl)methyl]-N-(2-methoxy-5-morpholinosulfonyl-phenyl)piperidine-3-carboxamide CAS Name: 1-[(4-bromophenyl)methyl]-N-[2-methoxy-5-(4-morpholinylsulfonyl)phenyl]-3-piperidinecarboxamide IUPAC Name: 1-[(4-bromophenyl)methyl]-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)piperidine-3-carboxamide Traditional Name: 1-(4-bromobenzyl)-N-(2-methoxy-5-morpholinosulfonyl-phenyl)nipecotamide Formula: C24H30BrN3O5S MolecularWeight: 552.4811

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C3CCCN(C3)CC4=CC=C(C=C4)Br

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C3CCCN(C3)CC4=CC=C(C=C4)Br

InChI

InChI=1S/C24H30BrN3O5S/c1-32-23-9-8-21(34(30,31)28-11-13-33-14-12-28)15-22(23)26-24(29)19-3-2-10-27(17-19)16-18-4-6-20(25)7-5-18/h4-9,15,19H,2-3,10-14,16-17H2,1H3,(H,26,29)