hexyl N-(2-oxidanylidene-5-pyridin-4-yl-1H-pyridin-3-yl)carbamate

Systemtic Name: hexyl N-(2-oxidanylidene-5-pyridin-4-yl-1H-pyridin-3-yl)carbamate Openeye Name: hexyl N-[2-oxo-5-(4-pyridyl)-1H-pyridin-3-yl]carbamate CAS Name: N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)carbamic acid hexyl ester IUPAC Name: hexyl N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)carbamate Traditional Name: N-[2-keto-5-(4-pyridyl)-1H-pyridin-3-yl]carbamic acid hexyl ester Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)NC1=CC(=CNC1=O)C2=CC=NC=C2

Isomeric SMILES

CCCCCCOC(=O)NC1=CC(=CNC1=O)C2=CC=NC=C2

InChI

InChI=1S/C17H21N3O3/c1-2-3-4-5-10-23-17(22)20-15-11-14(12-19-16(15)21)13-6-8-18-9-7-13/h6-9,11-12H,2-5,10H2,1H3,(H,19,21)(H,20,22)