3-[[3,5-dimethyl-4-[(2-methyl-7-oxidanyl-1-oxidanylidene-3H-isoindol-4-yl)oxy]phenyl]amino]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[[3,5-dimethyl-4-[(2-methyl-7-oxidanyl-1-oxidanylidene-3H-isoindol-4-yl)oxy]phenyl]amino]-3-oxidanylidene-propanoic acid Openeye Name: 3-[4-(7-hydroxy-2-methyl-1-oxo-isoindolin-4-yl)oxy-3,5-dimethyl-anilino]-3-oxo-propanoic acid CAS Name: 3-[4-[(7-hydroxy-2-methyl-1-oxo-3H-isoindol-4-yl)oxy]-3,5-dimethylanilino]-3-oxopropanoic acid IUPAC Name: 3-[4-[(7-hydroxy-2-methyl-1-oxo-3H-isoindol-4-yl)oxy]-3,5-dimethylanilino]-3-oxopropanoic acid Traditional Name: 3-[4-(7-hydroxy-1-keto-2-methyl-isoindolin-4-yl)oxy-3,5-dimethyl-anilino]-3-keto-propionic acid Formula: C20H20N2O6 MolecularWeight: 384.3826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC2=C3CN(C(=O)C3=C(C=C2)O)C)C)NC(=O)CC(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1OC2=C3CN(C(=O)C3=C(C=C2)O)C)C)NC(=O)CC(=O)O

InChI

InChI=1S/C20H20N2O6/c1-10-6-12(21-16(24)8-17(25)26)7-11(2)19(10)28-15-5-4-14(23)18-13(15)9-22(3)20(18)27/h4-7,23H,8-9H2,1-3H3,(H,21,24)(H,25,26)