N-(3-phenylmethoxypropyl)-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-phenylmethoxypropyl)-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-benzyloxypropyl)-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-(3-phenylmethoxypropyl)-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(3-phenylmethoxypropyl)-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(3-benzoxypropyl)-1-(3-pyridylsulfonyl)isonipecotamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCCOCC2=CC=CC=C2)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)NCCCOCC2=CC=CC=C2)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C21H27N3O4S/c25-21(23-12-5-15-28-17-18-6-2-1-3-7-18)19-9-13-24(14-10-19)29(26,27)20-8-4-11-22-16-20/h1-4,6-8,11,16,19H,5,9-10,12-15,17H2,(H,23,25)