2-chloranylprop-2-enyl (2S)-1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]pyrrolidine-2-carboxylate

Systemtic Name: 2-chloranylprop-2-enyl (2S)-1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]pyrrolidine-2-carboxylate Openeye Name: 2-chloroallyl (2S)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)pyrrolidine-2-carboxylate CAS Name: (2S)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)-2-pyrrolidinecarboxylic acid 2-chloroprop-2-enyl ester IUPAC Name: 2-chloroprop-2-enyl (2S)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)pyrrolidine-2-carboxylate Traditional Name: (2S)-1-(1,1-diketo-1,2-benzothiazol-3-yl)pyrrolidine-2-carboxylic acid 2-chloroallyl ester Formula: C15H15ClN2O4S MolecularWeight: 354.8086

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Descriptors Computed from Structure

Canonical SMILES:

C=C(COC(=O)C1CCCN1C2=NS(=O)(=O)C3=CC=CC=C32)Cl

Isomeric SMILES

C=C(COC(=O)[C@@H]1CCCN1C2=NS(=O)(=O)C3=CC=CC=C32)Cl

InChI

InChI=1S/C15H15ClN2O4S/c1-10(16)9-22-15(19)12-6-4-8-18(12)14-11-5-2-3-7-13(11)23(20,21)17-14/h2-3,5,7,12H,1,4,6,8-9H2/t12-/m0/s1