ethyl 2-(phenylmethoxycarbonylamino)-2-thiophen-3-yl-butanoate

Systemtic Name: ethyl 2-(phenylmethoxycarbonylamino)-2-thiophen-3-yl-butanoate Openeye Name: ethyl 2-(benzyloxycarbonylamino)-2-(3-thienyl)butanoate CAS Name: 2-(phenylmethoxycarbonylamino)-2-(3-thiophenyl)butanoic acid ethyl ester IUPAC Name: ethyl 2-(phenylmethoxycarbonylamino)-2-thiophen-3-ylbutanoate Traditional Name: 2-(benzyloxycarbonylamino)-2-(3-thienyl)butyric acid ethyl ester Formula: C18H21NO4S MolecularWeight: 347.42864

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CSC=C1)(C(=O)OCC)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCC(C1=CSC=C1)(C(=O)OCC)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H21NO4S/c1-3-18(16(20)22-4-2,15-10-11-24-13-15)19-17(21)23-12-14-8-6-5-7-9-14/h5-11,13H,3-4,12H2,1-2H3,(H,19,21)