3-(1H-indol-3-yl)-2-[2-(3-methylphenoxy)ethanoylamino]propanoic acid

Systemtic Name: 3-(1H-indol-3-yl)-2-[2-(3-methylphenoxy)ethanoylamino]propanoic acid Openeye Name: 3-(1H-indol-3-yl)-2-[[2-(3-methylphenoxy)acetyl]amino]propanoic acid CAS Name: 3-(1H-indol-3-yl)-2-[[2-(3-methylphenoxy)-1-oxoethyl]amino]propanoic acid IUPAC Name: 3-(1H-indol-3-yl)-2-[[2-(3-methylphenoxy)acetyl]amino]propanoic acid Traditional Name: 3-(1H-indol-3-yl)-2-[[2-(3-methylphenoxy)acetyl]amino]propionic acid Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)O

InChI

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