1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[2-methyl-5-(propanoylamino)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[2-methyl-5-(propanoylamino)phenyl]piperidine-4-carboxamide Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[2-methyl-5-(propanoylamino)phenyl]piperidine-4-carboxamide CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[2-methyl-5-(1-oxopropylamino)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[2-methyl-5-(propanoylamino)phenyl]piperidine-4-carboxamide Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(2-methyl-5-propionamido-phenyl)isonipecotamide Formula: C24H29N3O6S MolecularWeight: 487.56856

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=C(C=C1)C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCC(=O)NC1=CC(=C(C=C1)C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C24H29N3O6S/c1-3-23(28)25-18-5-4-16(2)20(14-18)26-24(29)17-8-10-27(11-9-17)34(30,31)19-6-7-21-22(15-19)33-13-12-32-21/h4-7,14-15,17H,3,8-13H2,1-2H3,(H,25,28)(H,26,29)