1,3-benzothiazol-2-ylmethyl 3-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]propanoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 3-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]propanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 3-(2,5-dioxopyrrolidin-1-yl)propanoate CAS Name: 3-(2,5-dioxo-1-pyrrolidinyl)propanoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 3-(2,5-dioxopyrrolidin-1-yl)propanoate Traditional Name: 3-succinimidopropionic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C15H14N2O4S MolecularWeight: 318.34766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1=O)CCC(=O)OCC2=NC3=CC=CC=C3S2

Isomeric SMILES

C1CC(=O)N(C1=O)CCC(=O)OCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C15H14N2O4S/c18-13-5-6-14(19)17(13)8-7-15(20)21-9-12-16-10-3-1-2-4-11(10)22-12/h1-4H,5-9H2