phenacyl (2R)-3-(1-benzothiophen-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: phenacyl (2R)-3-(1-benzothiophen-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: phenacyl (2R)-3-(benzothiophen-3-yl)-2-(tert-butoxycarbonylamino)propanoate CAS Name: (2R)-3-(1-benzothiophen-3-yl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid phenacyl ester IUPAC Name: phenacyl (2R)-3-(1-benzothiophen-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2R)-3-(benzothiophen-3-yl)-2-(tert-butoxycarbonylamino)propionic acid phenacyl ester Formula: C24H25NO5S MolecularWeight: 439.524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CSC2=CC=CC=C21)C(=O)OCC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H](CC1=CSC2=CC=CC=C21)C(=O)OCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H25NO5S/c1-24(2,3)30-23(28)25-19(13-17-15-31-21-12-8-7-11-18(17)21)22(27)29-14-20(26)16-9-5-4-6-10-16/h4-12,15,19H,13-14H2,1-3H3,(H,25,28)/t19-/m1/s1