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

Systemtic Name: [2-(dicyclohexylamino)-2-oxidanylidene-ethyl] 3,7-bis(chloranyl)-6-methoxy-1-benzothiophene-2-carboxylate Openeye Name: [2-(dicyclohexylamino)-2-oxo-ethyl] 3,7-dichloro-6-methoxy-benzothiophene-2-carboxylate CAS Name: 3,7-dichloro-6-methoxy-1-benzothiophene-2-carboxylic acid [2-(dicyclohexylamino)-2-oxoethyl] ester IUPAC Name: [2-(dicyclohexylamino)-2-oxoethyl] 3,7-dichloro-6-methoxy-1-benzothiophene-2-carboxylate Traditional Name: 3,7-dichloro-6-methoxy-benzothiophene-2-carboxylic acid [2-(dicyclohexylamino)-2-keto-ethyl] ester Formula: C24H29Cl2NO4S MolecularWeight: 498.46236

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(=C(S2)C(=O)OCC(=O)N(C3CCCCC3)C4CCCCC4)Cl)Cl

Isomeric SMILES

COC1=C(C2=C(C=C1)C(=C(S2)C(=O)OCC(=O)N(C3CCCCC3)C4CCCCC4)Cl)Cl

InChI

InChI=1S/C24H29Cl2NO4S/c1-30-18-13-12-17-20(25)23(32-22(17)21(18)26)24(29)31-14-19(28)27(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h12-13,15-16H,2-11,14H2,1H3