N-[3-[4-(1,4-dioxan-2-ylmethylamino)piperidin-1-yl]phenyl]pyridine-4-carboxamide

Systemtic Name: N-[3-[4-(1,4-dioxan-2-ylmethylamino)piperidin-1-yl]phenyl]pyridine-4-carboxamide Openeye Name: N-[3-[4-(1,4-dioxan-2-ylmethylamino)-1-piperidyl]phenyl]pyridine-4-carboxamide CAS Name: N-[3-[4-(1,4-dioxan-2-ylmethylamino)-1-piperidinyl]phenyl]-4-pyridinecarboxamide IUPAC Name: N-[3-[4-(1,4-dioxan-2-ylmethylamino)piperidin-1-yl]phenyl]pyridine-4-carboxamide Traditional Name: N-[3-[4-(1,4-dioxan-2-ylmethylamino)piperidino]phenyl]isonicotinamide Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NCC2COCCO2)C3=CC(=CC=C3)NC(=O)C4=CC=NC=C4

Isomeric SMILES

C1CN(CCC1NCC2COCCO2)C3=CC(=CC=C3)NC(=O)C4=CC=NC=C4

InChI

InChI=1S/C22H28N4O3/c27-22(17-4-8-23-9-5-17)25-19-2-1-3-20(14-19)26-10-6-18(7-11-26)24-15-21-16-28-12-13-29-21/h1-5,8-9,14,18,21,24H,6-7,10-13,15-16H2,(H,25,27)