phenacyl 3-(5-chloranyl-1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: phenacyl 3-(5-chloranyl-1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: phenacyl 2-(tert-butoxycarbonylamino)-3-(5-chloro-1H-indol-3-yl)propanoate CAS Name: 3-(5-chloro-1H-indol-3-yl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid phenacyl ester IUPAC Name: phenacyl 3-(5-chloro-1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 2-(tert-butoxycarbonylamino)-3-(5-chloro-1H-indol-3-yl)propionic acid phenacyl ester Formula: C24H25ClN2O5 MolecularWeight: 456.9187

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CNC2=C1C=C(C=C2)Cl)C(=O)OCC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CNC2=C1C=C(C=C2)Cl)C(=O)OCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H25ClN2O5/c1-24(2,3)32-23(30)27-20(11-16-13-26-19-10-9-17(25)12-18(16)19)22(29)31-14-21(28)15-7-5-4-6-8-15/h4-10,12-13,20,26H,11,14H2,1-3H3,(H,27,30)