ethyl 3-[2-(4-oxidanylidenepentanoyloxy)ethanoylamino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: ethyl 3-[2-(4-oxidanylidenepentanoyloxy)ethanoylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 3-[[2-(4-oxopentanoyloxy)acetyl]amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[2-(1,4-dioxopentoxy)-1-oxoethyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-(4-oxopentanoyloxy)acetyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[[2-(4-ketopentanoyloxy)acetyl]amino]-5-phenyl-thiophene-2-carboxylic acid ethyl ester Formula: C20H21NO6S MolecularWeight: 403.44884

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)COC(=O)CCC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)COC(=O)CCC(=O)C

InChI

InChI=1S/C20H21NO6S/c1-3-26-20(25)19-15(11-16(28-19)14-7-5-4-6-8-14)21-17(23)12-27-18(24)10-9-13(2)22/h4-8,11H,3,9-10,12H2,1-2H3,(H,21,23)