2-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-oxidanylidene-4,5-dihydro-3H-azepin-1-yl]ethanoic acid

Systemtic Name: 2-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-oxidanylidene-4,5-dihydro-3H-azepin-1-yl]ethanoic acid Openeye Name: 2-[3-(1,3-dioxoisoindolin-2-yl)-2-oxo-4,5-dihydro-3H-azepin-1-yl]acetic acid CAS Name: 2-[3-(1,3-dioxo-2-isoindolyl)-2-oxo-4,5-dihydro-3H-azepin-1-yl]acetic acid IUPAC Name: 2-[3-(1,3-dioxoisoindol-2-yl)-2-oxo-4,5-dihydro-3H-azepin-1-yl]acetic acid Traditional Name: 2-(2-keto-3-phthalimido-4,5-dihydro-3H-azepin-1-yl)acetic acid Formula: C16H14N2O5 MolecularWeight: 314.29276

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)N(C=C1)CC(=O)O)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1CC(C(=O)N(C=C1)CC(=O)O)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C16H14N2O5/c19-13(20)9-17-8-4-3-7-12(16(17)23)18-14(21)10-5-1-2-6-11(10)15(18)22/h1-2,4-6,8,12H,3,7,9H2,(H,19,20)