(2S)-2-[2,5-bis(oxidanylidene)pyrrol-1-yl]-3-phenyl-propanoate

Systemtic Name: (2S)-2-[2,5-bis(oxidanylidene)pyrrol-1-yl]-3-phenyl-propanoate Openeye Name: (2S)-2-(2,5-dioxopyrrol-1-yl)-3-phenyl-propanoate CAS Name: (2S)-2-(2,5-dioxo-1-pyrrolyl)-3-phenylpropanoate IUPAC Name: (2S)-2-(2,5-dioxopyrrol-1-yl)-3-phenylpropanoate Traditional Name: (2S)-2-maleimido-3-phenyl-propionate Formula: C13H10NO4- MolecularWeight: 244.2228

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)[O-])N2C(=O)C=CC2=O

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)[O-])N2C(=O)C=CC2=O

InChI

InChI=1S/C13H11NO4/c15-11-6-7-12(16)14(11)10(13(17)18)8-9-4-2-1-3-5-9/h1-7,10H,8H2,(H,17,18)/p-1/t10-/m0/s1