(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 3-[(4-chlorophenyl)carbonylamino]propanoate

Systemtic Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 3-[(4-chlorophenyl)carbonylamino]propanoate Openeye Name: [5-(2-thienyl)isoxazol-3-yl]methyl 3-[(4-chlorobenzoyl)amino]propanoate CAS Name: 3-[[(4-chlorophenyl)-oxomethyl]amino]propanoic acid (5-thiophen-2-yl-3-isoxazolyl)methyl ester IUPAC Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 3-[(4-chlorobenzoyl)amino]propanoate Traditional Name: 3-[(4-chlorobenzoyl)amino]propionic acid [5-(2-thienyl)isoxazol-3-yl]methyl ester Formula: C18H15ClN2O4S MolecularWeight: 390.8407

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=CC(=NO2)COC(=O)CCNC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CSC(=C1)C2=CC(=NO2)COC(=O)CCNC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H15ClN2O4S/c19-13-5-3-12(4-6-13)18(23)20-8-7-17(22)24-11-14-10-15(25-21-14)16-2-1-9-26-16/h1-6,9-10H,7-8,11H2,(H,20,23)