N-(1,3-benzodioxol-5-yl)-1-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)isonipecotamide Formula: C22H25N3O5S MolecularWeight: 443.516

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C22H25N3O5S/c26-22(23-19-5-6-20-21(13-19)30-15-29-20)17-8-10-24(11-9-17)31(27,28)25-12-7-16-3-1-2-4-18(16)14-25/h1-6,13,17H,7-12,14-15H2,(H,23,26)