N-[3-methoxy-4-[1-(pyridin-4-ylmethyl)piperidin-4-yl]carbonyl-phenyl]methanesulfonamide

Systemtic Name: N-[3-methoxy-4-[1-(pyridin-4-ylmethyl)piperidin-4-yl]carbonyl-phenyl]methanesulfonamide Openeye Name: N-[3-methoxy-4-[1-(4-pyridylmethyl)piperidine-4-carbonyl]phenyl]methanesulfonamide CAS Name: N-[3-methoxy-4-[oxo-[1-(pyridin-4-ylmethyl)-4-piperidinyl]methyl]phenyl]methanesulfonamide IUPAC Name: N-[3-methoxy-4-[1-(pyridin-4-ylmethyl)piperidine-4-carbonyl]phenyl]methanesulfonamide Traditional Name: N-[3-methoxy-4-[1-(4-pyridylmethyl)isonipecotoyl]phenyl]methanesulfonamide Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NS(=O)(=O)C)C(=O)C2CCN(CC2)CC3=CC=NC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)NS(=O)(=O)C)C(=O)C2CCN(CC2)CC3=CC=NC=C3

InChI

InChI=1S/C20H25N3O4S/c1-27-19-13-17(22-28(2,25)26)3-4-18(19)20(24)16-7-11-23(12-8-16)14-15-5-9-21-10-6-15/h3-6,9-10,13,16,22H,7-8,11-12,14H2,1-2H3