(2R)-2-[2-(4-tert-butylphenoxy)ethanoylamino]-3-(1H-indol-3-yl)propanoic acid

Systemtic Name: (2R)-2-[2-(4-tert-butylphenoxy)ethanoylamino]-3-(1H-indol-3-yl)propanoic acid Openeye Name: (2R)-2-[[2-(4-tert-butylphenoxy)acetyl]amino]-3-(1H-indol-3-yl)propanoic acid CAS Name: (2R)-2-[[2-(4-tert-butylphenoxy)-1-oxoethyl]amino]-3-(1H-indol-3-yl)propanoic acid IUPAC Name: (2R)-2-[[2-(4-tert-butylphenoxy)acetyl]amino]-3-(1H-indol-3-yl)propanoic acid Traditional Name: (2R)-2-[[2-(4-tert-butylphenoxy)acetyl]amino]-3-(1H-indol-3-yl)propionic acid Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC(=O)N[C@H](CC2=CNC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C23H26N2O4/c1-23(2,3)16-8-10-17(11-9-16)29-14-21(26)25-20(22(27)28)12-15-13-24-19-7-5-4-6-18(15)19/h4-11,13,20,24H,12,14H2,1-3H3,(H,25,26)(H,27,28)/t20-/m1/s1