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

Systemtic Name: diethyl 2-acetamido-2-(1-benzothiophen-3-ylmethyl)propanedioate Openeye Name: diethyl 2-acetamido-2-(benzothiophen-3-ylmethyl)propanedioate CAS Name: 2-acetamido-2-(1-benzothiophen-3-ylmethyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-(1-benzothiophen-3-ylmethyl)propanedioate Traditional Name: 2-acetamido-2-(benzothiophen-3-ylmethyl)malonic acid diethyl ester Formula: C18H21NO5S MolecularWeight: 363.42804

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CSC2=CC=CC=C21)(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CC1=CSC2=CC=CC=C21)(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C18H21NO5S/c1-4-23-16(21)18(19-12(3)20,17(22)24-5-2)10-13-11-25-15-9-7-6-8-14(13)15/h6-9,11H,4-5,10H2,1-3H3,(H,19,20)