[2-oxidanylidene-2-[[(2S)-2-phenylpropyl]amino]ethyl] 4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoate

Systemtic Name: [2-oxidanylidene-2-[[(2S)-2-phenylpropyl]amino]ethyl] 4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoate Openeye Name: [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] 4-(5-chloro-2-thienyl)-4-oxo-butanoate CAS Name: 4-(5-chloro-2-thiophenyl)-4-oxobutanoic acid [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] 4-(5-chlorothiophen-2-yl)-4-oxobutanoate Traditional Name: 4-(5-chloro-2-thienyl)-4-keto-butyric acid [2-keto-2-[[(2S)-2-phenylpropyl]amino]ethyl] ester Formula: C19H20ClNO4S MolecularWeight: 393.8844

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)COC(=O)CCC(=O)C1=CC=C(S1)Cl)C2=CC=CC=C2

Isomeric SMILES

C[C@H](CNC(=O)COC(=O)CCC(=O)C1=CC=C(S1)Cl)C2=CC=CC=C2

InChI

InChI=1S/C19H20ClNO4S/c1-13(14-5-3-2-4-6-14)11-21-18(23)12-25-19(24)10-7-15(22)16-8-9-17(20)26-16/h2-6,8-9,13H,7,10-12H2,1H3,(H,21,23)/t13-/m1/s1