2-acetamido-3-[6,7-bis(phenylmethoxy)-1H-indol-3-yl]propanoic acid

Systemtic Name: 2-acetamido-3-[6,7-bis(phenylmethoxy)-1H-indol-3-yl]propanoic acid Openeye Name: 2-acetamido-3-(6,7-dibenzyloxy-1H-indol-3-yl)propanoic acid CAS Name: 2-acetamido-3-[6,7-bis(phenylmethoxy)-1H-indol-3-yl]propanoic acid IUPAC Name: 2-acetamido-3-[6,7-bis(phenylmethoxy)-1H-indol-3-yl]propanoic acid Traditional Name: 2-acetamido-3-(6,7-dibenzoxy-1H-indol-3-yl)propionic acid Formula: C27H26N2O5 MolecularWeight: 458.50574

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CNC2=C1C=CC(=C2OCC3=CC=CC=C3)OCC4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC(=O)NC(CC1=CNC2=C1C=CC(=C2OCC3=CC=CC=C3)OCC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C27H26N2O5/c1-18(30)29-23(27(31)32)14-21-15-28-25-22(21)12-13-24(33-16-19-8-4-2-5-9-19)26(25)34-17-20-10-6-3-7-11-20/h2-13,15,23,28H,14,16-17H2,1H3,(H,29,30)(H,31,32)