ethyl (2S)-3-(4-ethynylphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: ethyl (2S)-3-(4-ethynylphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: ethyl (2S)-2-(tert-butoxycarbonylamino)-3-(4-ethynylphenyl)propanoate CAS Name: (2S)-3-(4-ethynylphenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-3-(4-ethynylphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-3-(4-ethynylphenyl)propionic acid ethyl ester Formula: C18H23NO4 MolecularWeight: 317.37952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=C(C=C1)C#C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)[C@H](CC1=CC=C(C=C1)C#C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C18H23NO4/c1-6-13-8-10-14(11-9-13)12-15(16(20)22-7-2)19-17(21)23-18(3,4)5/h1,8-11,15H,7,12H2,2-5H3,(H,19,21)/t15-/m0/s1