2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-(3-nitrophenyl)propanoic acid

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-(3-nitrophenyl)propanoic acid Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)-3-(3-nitrophenyl)propanoic acid CAS Name: 2-(1,3-dioxo-2-isoindolyl)-3-(3-nitrophenyl)propanoic acid IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)-3-(3-nitrophenyl)propanoic acid Traditional Name: 3-(3-nitrophenyl)-2-phthalimido-propionic acid Formula: C17H12N2O6 MolecularWeight: 340.28698

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)C(CC3=CC(=CC=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)C(CC3=CC(=CC=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C17H12N2O6/c20-15-12-6-1-2-7-13(12)16(21)18(15)14(17(22)23)9-10-4-3-5-11(8-10)19(24)25/h1-8,14H,9H2,(H,22,23)