(6-oxidanyl-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl)methyl 3-methyl-2-oxidanyl-butanoate

Systemtic Name: (6-oxidanyl-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl)methyl 3-methyl-2-oxidanyl-butanoate Openeye Name: (6-hydroxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl)methyl 2-hydroxy-3-methyl-butanoate CAS Name: 2-hydroxy-3-methylbutanoic acid (6-hydroxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl)methyl ester IUPAC Name: (6-hydroxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl)methyl 2-hydroxy-3-methylbutanoate Traditional Name: 2-hydroxy-3-methyl-butyric acid (6-hydroxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl)methyl ester Formula: C13H21NO4 MolecularWeight: 255.31014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CCN2C1CC(C2)O)O

Isomeric SMILES

CC(C)C(C(=O)OCC1=CCN2C1CC(C2)O)O

InChI

InChI=1S/C13H21NO4/c1-8(2)12(16)13(17)18-7-9-3-4-14-6-10(15)5-11(9)14/h3,8,10-12,15-16H,4-7H2,1-2H3