1-piperidin-1-ylsulfonyl-N-[(4-propan-2-yloxyphenyl)methyl]piperidine-3-carboxamide

Systemtic Name: 1-piperidin-1-ylsulfonyl-N-[(4-propan-2-yloxyphenyl)methyl]piperidine-3-carboxamide Openeye Name: N-[(4-isopropoxyphenyl)methyl]-1-(1-piperidylsulfonyl)piperidine-3-carboxamide CAS Name: 1-(1-piperidinylsulfonyl)-N-[(4-propan-2-yloxyphenyl)methyl]-3-piperidinecarboxamide IUPAC Name: 1-piperidin-1-ylsulfonyl-N-[(4-propan-2-yloxyphenyl)methyl]piperidine-3-carboxamide Traditional Name: N-(4-isopropoxybenzyl)-1-piperidinosulfonyl-nipecotamide Formula: C21H33N3O4S MolecularWeight: 423.56942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H33N3O4S/c1-17(2)28-20-10-8-18(9-11-20)15-22-21(25)19-7-6-14-24(16-19)29(26,27)23-12-4-3-5-13-23/h8-11,17,19H,3-7,12-16H2,1-2H3,(H,22,25)