6-[[6-(hydroxymethyl)-2-phenyl-4H-[1,3]dioxino[5,4-b]pyridin-8-yl]methylamino]hexanal

Systemtic Name: 6-[[6-(hydroxymethyl)-2-phenyl-4H-[1,3]dioxino[5,4-b]pyridin-8-yl]methylamino]hexanal Openeye Name: 6-[[6-(hydroxymethyl)-2-phenyl-4H-[1,3]dioxino[5,4-b]pyridin-8-yl]methylamino]hexanal CAS Name: 6-[[6-(hydroxymethyl)-2-phenyl-4H-[1,3]dioxino[5,4-b]pyridin-8-yl]methylamino]hexanal IUPAC Name: 6-[[6-(hydroxymethyl)-2-phenyl-4H-[1,3]dioxino[5,4-b]pyridin-8-yl]methylamino]hexanal Traditional Name: 6-[(6-methylol-2-phenyl-4H-[1,3]dioxino[5,4-b]pyridin-8-yl)methylamino]hexanal Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C(=CC(=N2)CO)CNCCCCCC=O)OC(O1)C3=CC=CC=C3

Isomeric SMILES

C1C2=C(C(=CC(=N2)CO)CNCCCCCC=O)OC(O1)C3=CC=CC=C3

InChI

InChI=1S/C21H26N2O4/c24-11-7-2-1-6-10-22-13-17-12-18(14-25)23-19-15-26-21(27-20(17)19)16-8-4-3-5-9-16/h3-5,8-9,11-12,21-22,25H,1-2,6-7,10,13-15H2