(2S)-2-[[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-isochroman-7-carbonyl]amino]butanedioic acid

Molecular Formula: C15H14ClNO8


InChI: InChI=1/C15H14ClNO8/c1-5-2-6-8(16)3-7(12(20)11(6)15(24)25-5)13(21)17-9(14(22)23)4-10(18)19/h3,5,9,20H,2,4H2,1H3,(H,17,21)(H,18,19)(H,22,23)/t5-,9+/m1/s1/f/h17-18,22H

InChIKey: InChIKey=CJSROLWTKDASEV-VDZVELQCDT
SMILES: CC1CC2=C(C=C(C(=C2C(=O)O1)O)C(=O)NC(CC(=O)O)C(=O)O)Cl

Names:
    ASPARTIC ACID, N-((5-CHLORO-8-HYDROXY-3-METHYL-1-OXO-7-ISOCHROMANYL)CARBONYL)-
    N-((5-Chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl)carbonyl)aspartic acid
    (2S)-2-[[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-isochroman-7-carbonyl]amino]butanedioic acid
    56222-81-2

Registries:
    PubChem CID 3033114
    PubChem ID 182454