[2-[1,3-benzothiazol-2-yl(ethyl)amino]-2-oxidanylidene-ethyl] 3-(2-methoxyphenoxy)propanoate

Systemtic Name: [2-[1,3-benzothiazol-2-yl(ethyl)amino]-2-oxidanylidene-ethyl] 3-(2-methoxyphenoxy)propanoate Openeye Name: [2-[1,3-benzothiazol-2-yl(ethyl)amino]-2-oxo-ethyl] 3-(2-methoxyphenoxy)propanoate CAS Name: 3-(2-methoxyphenoxy)propanoic acid [2-[1,3-benzothiazol-2-yl(ethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[1,3-benzothiazol-2-yl(ethyl)amino]-2-oxoethyl] 3-(2-methoxyphenoxy)propanoate Traditional Name: 3-(2-methoxyphenoxy)propionic acid [2-[1,3-benzothiazol-2-yl(ethyl)amino]-2-keto-ethyl] ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NC2=CC=CC=C2S1)C(=O)COC(=O)CCOC3=CC=CC=C3OC

Isomeric SMILES

CCN(C1=NC2=CC=CC=C2S1)C(=O)COC(=O)CCOC3=CC=CC=C3OC

InChI

InChI=1S/C21H22N2O5S/c1-3-23(21-22-15-8-4-7-11-18(15)29-21)19(24)14-28-20(25)12-13-27-17-10-6-5-9-16(17)26-2/h4-11H,3,12-14H2,1-2H3