(2R)-4-methyl-2-[[(2R,3S)-3-methyl-3-oxidanyl-oxan-2-yl]azaniumyl]pentanoate

Systemtic Name: (2R)-4-methyl-2-[[(2R,3S)-3-methyl-3-oxidanyl-oxan-2-yl]azaniumyl]pentanoate Openeye Name: (2R)-2-[[(2R,3S)-3-hydroxy-3-methyl-tetrahydropyran-2-yl]ammonio]-4-methyl-pentanoate CAS Name: (2R)-2-[[(2R,3S)-3-hydroxy-3-methyl-2-oxanyl]ammonio]-4-methylpentanoate IUPAC Name: (2R)-2-[[(2R,3S)-3-hydroxy-3-methyloxan-2-yl]azaniumyl]-4-methylpentanoate Traditional Name: (2R)-2-[[(2R,3S)-3-hydroxy-3-methyl-tetrahydropyran-2-yl]ammonio]-4-methyl-valerate Formula: C12H23NO4 MolecularWeight: 245.31532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])[NH2+]C1C(CCCO1)(C)O

Isomeric SMILES

CC(C)C[C@H](C(=O)[O-])[NH2+][C@H]1[C@@](CCCO1)(C)O

InChI

InChI=1S/C12H23NO4/c1-8(2)7-9(10(14)15)13-11-12(3,16)5-4-6-17-11/h8-9,11,13,16H,4-7H2,1-3H3,(H,14,15)/t9-,11-,12+/m1/s1