N-(1,3-benzodioxol-5-yl)-1-[4-(3-bromanylphenoxy)butanoyl]piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[4-(3-bromanylphenoxy)butanoyl]piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-[4-(3-bromophenoxy)butanoyl]piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[4-(3-bromophenoxy)-1-oxobutyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-[4-(3-bromophenoxy)butanoyl]piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-[4-(3-bromophenoxy)butanoyl]isonipecotamide Formula: C23H25BrN2O5 MolecularWeight: 489.359

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)C(=O)CCCOC4=CC(=CC=C4)Br

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)C(=O)CCCOC4=CC(=CC=C4)Br

InChI

InChI=1S/C23H25BrN2O5/c24-17-3-1-4-19(13-17)29-12-2-5-22(27)26-10-8-16(9-11-26)23(28)25-18-6-7-20-21(14-18)31-15-30-20/h1,3-4,6-7,13-14,16H,2,5,8-12,15H2,(H,25,28)