[2-[(4-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl] 3,7-bis(chloranyl)-6-methoxy-1-benzothiophene-2-carboxylate

Systemtic Name: [2-[(4-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl] 3,7-bis(chloranyl)-6-methoxy-1-benzothiophene-2-carboxylate Openeye Name: [2-[(4-methoxyphenyl)methylamino]-2-oxo-ethyl] 3,7-dichloro-6-methoxy-benzothiophene-2-carboxylate CAS Name: 3,7-dichloro-6-methoxy-1-benzothiophene-2-carboxylic acid [2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] 3,7-dichloro-6-methoxy-1-benzothiophene-2-carboxylate Traditional Name: 3,7-dichloro-6-methoxy-benzothiophene-2-carboxylic acid [2-keto-2-(p-anisylamino)ethyl] ester Formula: C20H17Cl2NO5S MolecularWeight: 454.32368

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)COC(=O)C2=C(C3=C(S2)C(=C(C=C3)OC)Cl)Cl

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)COC(=O)C2=C(C3=C(S2)C(=C(C=C3)OC)Cl)Cl

InChI

InChI=1S/C20H17Cl2NO5S/c1-26-12-5-3-11(4-6-12)9-23-15(24)10-28-20(25)19-16(21)13-7-8-14(27-2)17(22)18(13)29-19/h3-8H,9-10H2,1-2H3,(H,23,24)