tert-butyl (2S)-3-(5,7-dimethyl-1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: tert-butyl (2S)-3-(5,7-dimethyl-1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: tert-butyl (2S)-2-(tert-butoxycarbonylamino)-3-(5,7-dimethyl-1H-indol-3-yl)propanoate CAS Name: (2S)-3-(5,7-dimethyl-1H-indol-3-yl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-3-(5,7-dimethyl-1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-3-(5,7-dimethyl-1H-indol-3-yl)propionic acid tert-butyl ester Formula: C22H32N2O4 MolecularWeight: 388.50048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CN2)CC(C(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CN2)C[C@@H](C(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)C

InChI

InChI=1S/C22H32N2O4/c1-13-9-14(2)18-16(10-13)15(12-23-18)11-17(19(25)27-21(3,4)5)24-20(26)28-22(6,7)8/h9-10,12,17,23H,11H2,1-8H3,(H,24,26)/t17-/m0/s1