3-[5-[(2-ethoxyphenyl)carbonylamino]-1,3-bis(oxidanylidene)isoindol-2-yl]propanoic acid

Systemtic Name: 3-[5-[(2-ethoxyphenyl)carbonylamino]-1,3-bis(oxidanylidene)isoindol-2-yl]propanoic acid Openeye Name: 3-[5-[(2-ethoxybenzoyl)amino]-1,3-dioxo-isoindolin-2-yl]propanoic acid CAS Name: 3-[5-[[(2-ethoxyphenyl)-oxomethyl]amino]-1,3-dioxo-2-isoindolyl]propanoic acid IUPAC Name: 3-[5-[(2-ethoxybenzoyl)amino]-1,3-dioxoisoindol-2-yl]propanoic acid Traditional Name: 3-[5-[(2-ethoxybenzoyl)amino]-1,3-diketo-isoindolin-2-yl]propionic acid Formula: C20H18N2O6 MolecularWeight: 382.36672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)NC2=CC3=C(C=C2)C(=O)N(C3=O)CCC(=O)O

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)NC2=CC3=C(C=C2)C(=O)N(C3=O)CCC(=O)O

InChI

InChI=1S/C20H18N2O6/c1-2-28-16-6-4-3-5-14(16)18(25)21-12-7-8-13-15(11-12)20(27)22(19(13)26)10-9-17(23)24/h3-8,11H,2,9-10H2,1H3,(H,21,25)(H,23,24)