N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-(1H-imidazol-5-ylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-(1H-imidazol-5-ylsulfonyl)isonipecotamide Formula: C18H22N4O5S MolecularWeight: 406.45608

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2COC3=CC=CC=C3O2)S(=O)(=O)C4=CN=CN4

Isomeric SMILES

C1CN(CCC1C(=O)NCC2COC3=CC=CC=C3O2)S(=O)(=O)C4=CN=CN4

InChI

InChI=1S/C18H22N4O5S/c23-18(20-9-14-11-26-15-3-1-2-4-16(15)27-14)13-5-7-22(8-6-13)28(24,25)17-10-19-12-21-17/h1-4,10,12-14H,5-9,11H2,(H,19,21)(H,20,23)