[5-(3-methylbutoxy)oxolan-3-yl]methyl 3-azanyl-2-methyl-pyridine-4-carboxylate

Systemtic Name: [5-(3-methylbutoxy)oxolan-3-yl]methyl 3-azanyl-2-methyl-pyridine-4-carboxylate Openeye Name: (5-isopentyloxytetrahydrofuran-3-yl)methyl 3-amino-2-methyl-pyridine-4-carboxylate CAS Name: 3-amino-2-methyl-4-pyridinecarboxylic acid [5-(3-methylbutoxy)-3-oxolanyl]methyl ester IUPAC Name: [5-(3-methylbutoxy)oxolan-3-yl]methyl 3-amino-2-methylpyridine-4-carboxylate Traditional Name: 3-amino-2-methyl-isonicotinic acid (5-isoamoxytetrahydrofuran-3-yl)methyl ester Formula: C17H26N2O4 MolecularWeight: 322.39934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=C1N)C(=O)OCC2CC(OC2)OCCC(C)C

Isomeric SMILES

CC1=NC=CC(=C1N)C(=O)OCC2CC(OC2)OCCC(C)C

InChI

InChI=1S/C17H26N2O4/c1-11(2)5-7-21-15-8-13(9-22-15)10-23-17(20)14-4-6-19-12(3)16(14)18/h4,6,11,13,15H,5,7-10,18H2,1-3H3