ethyl 3-[2-(2,3-dimethoxyphenyl)carbonylimino-1,3-benzothiazol-3-yl]propanoate

Systemtic Name: ethyl 3-[2-(2,3-dimethoxyphenyl)carbonylimino-1,3-benzothiazol-3-yl]propanoate Openeye Name: ethyl 3-[2-(2,3-dimethoxybenzoyl)imino-1,3-benzothiazol-3-yl]propanoate CAS Name: 3-[2-[(2,3-dimethoxyphenyl)-oxomethyl]imino-1,3-benzothiazol-3-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[2-(2,3-dimethoxybenzoyl)imino-1,3-benzothiazol-3-yl]propanoate Traditional Name: 3-(2-o-veratroylimino-1,3-benzothiazol-3-yl)propionic acid ethyl ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C2=CC=CC=C2SC1=NC(=O)C3=C(C(=CC=C3)OC)OC

Isomeric SMILES

CCOC(=O)CCN1C2=CC=CC=C2SC1=NC(=O)C3=C(C(=CC=C3)OC)OC

InChI

InChI=1S/C21H22N2O5S/c1-4-28-18(24)12-13-23-15-9-5-6-11-17(15)29-21(23)22-20(25)14-8-7-10-16(26-2)19(14)27-3/h5-11H,4,12-13H2,1-3H3