2-[[1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindol-5-yl]carbonylamino]-3-oxidanyl-butanoic acid

Systemtic Name: 2-[[1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindol-5-yl]carbonylamino]-3-oxidanyl-butanoic acid Openeye Name: 2-[(2-allyl-1,3-dioxo-isoindoline-5-carbonyl)amino]-3-hydroxy-butanoic acid CAS Name: 2-[[(1,3-dioxo-2-prop-2-enyl-5-isoindolyl)-oxomethyl]amino]-3-hydroxybutanoic acid IUPAC Name: 2-[(1,3-dioxo-2-prop-2-enylisoindole-5-carbonyl)amino]-3-hydroxybutanoic acid Traditional Name: 2-[(2-allyl-1,3-diketo-isoindoline-5-carbonyl)amino]-3-hydroxy-butyric acid Formula: C16H16N2O6 MolecularWeight: 332.30804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CC=C)O

Isomeric SMILES

CC(C(C(=O)O)NC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CC=C)O

InChI

InChI=1S/C16H16N2O6/c1-3-6-18-14(21)10-5-4-9(7-11(10)15(18)22)13(20)17-12(8(2)19)16(23)24/h3-5,7-8,12,19H,1,6H2,2H3,(H,17,20)(H,23,24)