ethyl 3-[6-chloranyl-2-(4-methoxyphenyl)carbonylimino-1,3-benzothiazol-3-yl]propanoate

Systemtic Name: ethyl 3-[6-chloranyl-2-(4-methoxyphenyl)carbonylimino-1,3-benzothiazol-3-yl]propanoate Openeye Name: ethyl 3-[6-chloro-2-(4-methoxybenzoyl)imino-1,3-benzothiazol-3-yl]propanoate CAS Name: 3-[6-chloro-2-[(4-methoxyphenyl)-oxomethyl]imino-1,3-benzothiazol-3-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[6-chloro-2-(4-methoxybenzoyl)imino-1,3-benzothiazol-3-yl]propanoate Traditional Name: 3-(6-chloro-2-p-anisoylimino-1,3-benzothiazol-3-yl)propionic acid ethyl ester Formula: C20H19ClN2O4S MolecularWeight: 418.89386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C2=C(C=C(C=C2)Cl)SC1=NC(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)CCN1C2=C(C=C(C=C2)Cl)SC1=NC(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H19ClN2O4S/c1-3-27-18(24)10-11-23-16-9-6-14(21)12-17(16)28-20(23)22-19(25)13-4-7-15(26-2)8-5-13/h4-9,12H,3,10-11H2,1-2H3