(4-oxidanylidene-4-thiophen-2-yl-butyl) (2S)-2-[(2-chlorophenyl)carbonylamino]propanoate

Systemtic Name: (4-oxidanylidene-4-thiophen-2-yl-butyl) (2S)-2-[(2-chlorophenyl)carbonylamino]propanoate Openeye Name: [4-oxo-4-(2-thienyl)butyl] (2S)-2-[(2-chlorobenzoyl)amino]propanoate CAS Name: (2S)-2-[[(2-chlorophenyl)-oxomethyl]amino]propanoic acid (4-oxo-4-thiophen-2-ylbutyl) ester IUPAC Name: (4-oxo-4-thiophen-2-ylbutyl) (2S)-2-[(2-chlorobenzoyl)amino]propanoate Traditional Name: (2S)-2-[(2-chlorobenzoyl)amino]propionic acid [4-keto-4-(2-thienyl)butyl] ester Formula: C18H18ClNO4S MolecularWeight: 379.85782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCCCC(=O)C1=CC=CS1)NC(=O)C2=CC=CC=C2Cl

Isomeric SMILES

C[C@@H](C(=O)OCCCC(=O)C1=CC=CS1)NC(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C18H18ClNO4S/c1-12(20-17(22)13-6-2-3-7-14(13)19)18(23)24-10-4-8-15(21)16-9-5-11-25-16/h2-3,5-7,9,11-12H,4,8,10H2,1H3,(H,20,22)/t12-/m0/s1