ethyl (2S)-1-[(2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]-2,3-dihydroindole-2-carboxylate

Systemtic Name: ethyl (2S)-1-[(2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]-2,3-dihydroindole-2-carboxylate Openeye Name: ethyl (2S)-1-[(2S)-2-(tert-butoxycarbonylamino)-3-methyl-butanoyl]indoline-2-carboxylate CAS Name: (2S)-1-[(2S)-3-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxobutyl]-2,3-dihydroindole-2-carboxylic acid ethyl ester IUPAC Name: ethyl (2S)-1-[(2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]-2,3-dihydroindole-2-carboxylate Traditional Name: (2S)-1-[(2S)-2-(tert-butoxycarbonylamino)-3-methyl-butanoyl]indoline-2-carboxylic acid ethyl ester Formula: C21H30N2O5 MolecularWeight: 390.4733

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC2=CC=CC=C2N1C(=O)C(C(C)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)[C@@H]1CC2=CC=CC=C2N1C(=O)[C@H](C(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H30N2O5/c1-7-27-19(25)16-12-14-10-8-9-11-15(14)23(16)18(24)17(13(2)3)22-20(26)28-21(4,5)6/h8-11,13,16-17H,7,12H2,1-6H3,(H,22,26)/t16-,17-/m0/s1