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

Systemtic Name: methyl 3-[6-methoxy-2-(4-methoxyphenyl)carbonylimino-1,3-benzothiazol-3-yl]propanoate Openeye Name: methyl 3-[6-methoxy-2-(4-methoxybenzoyl)imino-1,3-benzothiazol-3-yl]propanoate CAS Name: 3-[6-methoxy-2-[(4-methoxyphenyl)-oxomethyl]imino-1,3-benzothiazol-3-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[6-methoxy-2-(4-methoxybenzoyl)imino-1,3-benzothiazol-3-yl]propanoate Traditional Name: 3-(6-methoxy-2-p-anisoylimino-1,3-benzothiazol-3-yl)propionic acid methyl ester Formula: C20H20N2O5S MolecularWeight: 400.4482

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)OC)CCC(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)OC)CCC(=O)OC

InChI

InChI=1S/C20H20N2O5S/c1-25-14-6-4-13(5-7-14)19(24)21-20-22(11-10-18(23)27-3)16-9-8-15(26-2)12-17(16)28-20/h4-9,12H,10-11H2,1-3H3