diethyl 2-(1-benzothiophen-2-ylmethyl)-2-(1-benzothiophen-3-ylmethyl)propanedioate

Systemtic Name: diethyl 2-(1-benzothiophen-2-ylmethyl)-2-(1-benzothiophen-3-ylmethyl)propanedioate Openeye Name: diethyl 2-(benzothiophen-2-ylmethyl)-2-(benzothiophen-3-ylmethyl)propanedioate CAS Name: 2-(1-benzothiophen-2-ylmethyl)-2-(1-benzothiophen-3-ylmethyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(1-benzothiophen-2-ylmethyl)-2-(1-benzothiophen-3-ylmethyl)propanedioate Traditional Name: 2-(benzothiophen-2-ylmethyl)-2-(benzothiophen-3-ylmethyl)malonic acid diethyl ester Formula: C25H24O4S2 MolecularWeight: 452.58566

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC2=CC=CC=C2S1)(CC3=CSC4=CC=CC=C43)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CC1=CC2=CC=CC=C2S1)(CC3=CSC4=CC=CC=C43)C(=O)OCC

InChI

InChI=1S/C25H24O4S2/c1-3-28-23(26)25(24(27)29-4-2,14-18-16-30-22-12-8-6-10-20(18)22)15-19-13-17-9-5-7-11-21(17)31-19/h5-13,16H,3-4,14-15H2,1-2H3