ethyl (2S)-2-deuterio-3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: ethyl (2S)-2-deuterio-3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: ethyl (2S)-2-(benzyloxycarbonylamino)-2-deuterio-3-(1H-indol-3-yl)propanoate CAS Name: (2S)-2-deuterio-3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-deuterio-3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-2-deuterio-3-(1H-indol-3-yl)propionic acid ethyl ester Formula: C21H22N2O4 MolecularWeight: 367.416542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

[2H][C@](CC1=CNC2=CC=CC=C21)(C(=O)OCC)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O4/c1-2-26-20(24)19(12-16-13-22-18-11-7-6-10-17(16)18)23-21(25)27-14-15-8-4-3-5-9-15/h3-11,13,19,22H,2,12,14H2,1H3,(H,23,25)/t19-/m0/s1/i19D