4-[[(2S)-butan-2-yl]-(furan-2-ylmethyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[(2S)-butan-2-yl]-(furan-2-ylmethyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-furylmethyl-[(1S)-1-methylpropyl]amino]-4-oxo-butanoic acid CAS Name: 4-[[(2S)-butan-2-yl]-(2-furanylmethyl)amino]-4-oxobutanoic acid IUPAC Name: 4-[[(2S)-butan-2-yl]-(furan-2-ylmethyl)amino]-4-oxobutanoic acid Traditional Name: 4-[2-furfuryl-[(1S)-1-methylpropyl]amino]-4-keto-butyric acid Formula: C13H19NO4 MolecularWeight: 253.29426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC1=CC=CO1)C(=O)CCC(=O)O

Isomeric SMILES

CC[C@H](C)N(CC1=CC=CO1)C(=O)CCC(=O)O

InChI

InChI=1S/C13H19NO4/c1-3-10(2)14(9-11-5-4-8-18-11)12(15)6-7-13(16)17/h4-5,8,10H,3,6-7,9H2,1-2H3,(H,16,17)/t10-/m0/s1