3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)butanoic acid

Systemtic Name: 3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)butanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-3-(1H-indol-3-yl)butanoic acid CAS Name: 3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)butanoic acid IUPAC Name: 3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)butanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-3-(1H-indol-3-yl)butyric acid Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CNC2=CC=CC=C21)C(C(=O)O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C1=CNC2=CC=CC=C21)C(C(=O)O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H20N2O4/c1-13(16-11-21-17-10-6-5-9-15(16)17)18(19(23)24)22-20(25)26-12-14-7-3-2-4-8-14/h2-11,13,18,21H,12H2,1H3,(H,22,25)(H,23,24)