2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]ethyl 2-chloranyl-2-phenyl-ethanoate

Systemtic Name: 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]ethyl 2-chloranyl-2-phenyl-ethanoate Openeye Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]ethyl 2-chloro-2-phenyl-acetate CAS Name: 2-chloro-2-phenylacetic acid 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]ethyl ester IUPAC Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]ethyl 2-chloro-2-phenylacetate Traditional Name: 2-chloro-2-phenyl-acetic acid 2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]ethyl ester Formula: C17H15ClN2O4S MolecularWeight: 378.83

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)OCCNC2=NS(=O)(=O)C3=CC=CC=C32)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)OCCNC2=NS(=O)(=O)C3=CC=CC=C32)Cl

InChI

InChI=1S/C17H15ClN2O4S/c18-15(12-6-2-1-3-7-12)17(21)24-11-10-19-16-13-8-4-5-9-14(13)25(22,23)20-16/h1-9,15H,10-11H2,(H,19,20)