2-[4-(furan-2-ylmethylamino)-1,3-bis(oxidanylidene)isoindol-2-yl]pentanedioic acid

Systemtic Name: 2-[4-(furan-2-ylmethylamino)-1,3-bis(oxidanylidene)isoindol-2-yl]pentanedioic acid Openeye Name: 2-[4-(2-furylmethylamino)-1,3-dioxo-isoindolin-2-yl]pentanedioic acid CAS Name: 2-[4-(2-furanylmethylamino)-1,3-dioxo-2-isoindolyl]pentanedioic acid IUPAC Name: 2-[4-(furan-2-ylmethylamino)-1,3-dioxoisoindol-2-yl]pentanedioic acid Traditional Name: 2-[4-(2-furfurylamino)-1,3-diketo-isoindolin-2-yl]glutaric acid Formula: C18H16N2O7 MolecularWeight: 372.32884

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)NCC3=CC=CO3)C(=O)N(C2=O)C(CCC(=O)O)C(=O)O

Isomeric SMILES

C1=CC2=C(C(=C1)NCC3=CC=CO3)C(=O)N(C2=O)C(CCC(=O)O)C(=O)O

InChI

InChI=1S/C18H16N2O7/c21-14(22)7-6-13(18(25)26)20-16(23)11-4-1-5-12(15(11)17(20)24)19-9-10-3-2-8-27-10/h1-5,8,13,19H,6-7,9H2,(H,21,22)(H,25,26)