1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidine-4-carbonitrile

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidine-4-carbonitrile Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidine-4-carbonitrile CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-piperidinecarbonitrile IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidine-4-carbonitrile Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)isonipecotonitrile Formula: C14H16N2O4S MolecularWeight: 308.35284

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C#N)S(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C1CN(CCC1C#N)S(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C14H16N2O4S/c15-10-11-3-5-16(6-4-11)21(17,18)12-1-2-13-14(9-12)20-8-7-19-13/h1-2,9,11H,3-8H2