3-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-(2-chloranyl-5-nitro-phenyl)propanoic acid

Systemtic Name: 3-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-(2-chloranyl-5-nitro-phenyl)propanoic acid Openeye Name: 3-(2-chloro-5-nitro-phenyl)-3-(1,3-dioxoisoindolin-2-yl)propanoic acid CAS Name: 3-(2-chloro-5-nitrophenyl)-3-(1,3-dioxo-2-isoindolyl)propanoic acid IUPAC Name: 3-(2-chloro-5-nitrophenyl)-3-(1,3-dioxoisoindol-2-yl)propanoic acid Traditional Name: 3-(2-chloro-5-nitro-phenyl)-3-phthalimido-propionic acid Formula: C17H11ClN2O6 MolecularWeight: 374.73204

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H11ClN2O6/c18-13-6-5-9(20(25)26)7-12(13)14(8-15(21)22)19-16(23)10-3-1-2-4-11(10)17(19)24/h1-7,14H,8H2,(H,21,22)