(Z)-3-azanyl-4-[1,3-bis(oxidanylidene)isoindol-2-yl]but-2-enoic acid

Systemtic Name: (Z)-3-azanyl-4-[1,3-bis(oxidanylidene)isoindol-2-yl]but-2-enoic acid Openeye Name: (Z)-3-amino-4-(1,3-dioxoisoindolin-2-yl)but-2-enoic acid CAS Name: (Z)-3-amino-4-(1,3-dioxo-2-isoindolyl)-2-butenoic acid IUPAC Name: (Z)-3-amino-4-(1,3-dioxoisoindol-2-yl)but-2-enoic acid Traditional Name: (Z)-3-amino-4-phthalimido-but-2-enoic acid Formula: C12H10N2O4 MolecularWeight: 246.2188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)C/C(=C/C(=O)O)/N

InChI

InChI=1S/C12H10N2O4/c13-7(5-10(15)16)6-14-11(17)8-3-1-2-4-9(8)12(14)18/h1-5H,6,13H2,(H,15,16)/b7-5-