5-azanyl-2-[5-[1,3-bis(oxidanylidene)isoindol-2-yl]pentoxy]benzoic acid

Systemtic Name: 5-azanyl-2-[5-[1,3-bis(oxidanylidene)isoindol-2-yl]pentoxy]benzoic acid Openeye Name: 5-amino-2-[5-(1,3-dioxoisoindolin-2-yl)pentoxy]benzoic acid CAS Name: 5-amino-2-[5-(1,3-dioxo-2-isoindolyl)pentoxy]benzoic acid IUPAC Name: 5-amino-2-[5-(1,3-dioxoisoindol-2-yl)pentoxy]benzoic acid Traditional Name: 5-amino-2-(5-phthalimidopentoxy)benzoic acid Formula: C20H20N2O5 MolecularWeight: 368.3832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCOC3=C(C=C(C=C3)N)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCOC3=C(C=C(C=C3)N)C(=O)O

InChI

InChI=1S/C20H20N2O5/c21-13-8-9-17(16(12-13)20(25)26)27-11-5-1-4-10-22-18(23)14-6-2-3-7-15(14)19(22)24/h2-3,6-9,12H,1,4-5,10-11,21H2,(H,25,26)