3-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-(4-methoxy-3-propoxy-phenyl)propanoic acid

Systemtic Name: 3-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-(4-methoxy-3-propoxy-phenyl)propanoic acid Openeye Name: 3-(1,3-dioxoisoindolin-2-yl)-3-(4-methoxy-3-propoxy-phenyl)propanoic acid CAS Name: 3-(1,3-dioxo-2-isoindolyl)-3-(4-methoxy-3-propoxyphenyl)propanoic acid IUPAC Name: 3-(1,3-dioxoisoindol-2-yl)-3-(4-methoxy-3-propoxyphenyl)propanoic acid Traditional Name: 3-(4-methoxy-3-propoxy-phenyl)-3-phthalimido-propionic acid Formula: C21H21NO6 MolecularWeight: 383.39454

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC(=C1)C(CC(=O)O)N2C(=O)C3=CC=CC=C3C2=O)OC

Isomeric SMILES

CCCOC1=C(C=CC(=C1)C(CC(=O)O)N2C(=O)C3=CC=CC=C3C2=O)OC

InChI

InChI=1S/C21H21NO6/c1-3-10-28-18-11-13(8-9-17(18)27-2)16(12-19(23)24)22-20(25)14-6-4-5-7-15(14)21(22)26/h4-9,11,16H,3,10,12H2,1-2H3,(H,23,24)