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

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[2-(phenylmethyl)phenyl]piperidine-4-carboxamide Openeye Name: N-(2-benzylphenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidine-4-carboxamide CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[2-(phenylmethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: N-(2-benzylphenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidine-4-carboxamide Traditional Name: N-(2-benzylphenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)isonipecotamide Formula: C27H28N2O5S MolecularWeight: 492.58662

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=CC=C2CC3=CC=CC=C3)S(=O)(=O)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=CC=C2CC3=CC=CC=C3)S(=O)(=O)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C27H28N2O5S/c30-27(28-24-9-5-4-8-22(24)18-20-6-2-1-3-7-20)21-12-14-29(15-13-21)35(31,32)23-10-11-25-26(19-23)34-17-16-33-25/h1-11,19,21H,12-18H2,(H,28,30)