ethyl 4-[[3,7-bis(chloranyl)-6-methoxy-1-benzothiophen-2-yl]carbonyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[3,7-bis(chloranyl)-6-methoxy-1-benzothiophen-2-yl]carbonyl]piperazine-1-carboxylate Openeye Name: ethyl 4-(3,7-dichloro-6-methoxy-benzothiophene-2-carbonyl)piperazine-1-carboxylate CAS Name: 4-[(3,7-dichloro-6-methoxy-1-benzothiophen-2-yl)-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3,7-dichloro-6-methoxy-1-benzothiophene-2-carbonyl)piperazine-1-carboxylate Traditional Name: 4-(3,7-dichloro-6-methoxy-benzothiophene-2-carbonyl)piperazine-1-carboxylic acid ethyl ester Formula: C17H18Cl2N2O4S MolecularWeight: 417.30682

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=C(C3=C(S2)C(=C(C=C3)OC)Cl)Cl

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=C(C3=C(S2)C(=C(C=C3)OC)Cl)Cl

InChI

InChI=1S/C17H18Cl2N2O4S/c1-3-25-17(23)21-8-6-20(7-9-21)16(22)15-12(18)10-4-5-11(24-2)13(19)14(10)26-15/h4-5H,3,6-9H2,1-2H3