3-(1-methylindol-3-yl)-2-(phenylmethoxycarbonylamino)propanoic acid

Systemtic Name: 3-(1-methylindol-3-yl)-2-(phenylmethoxycarbonylamino)propanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-3-(1-methylindol-3-yl)propanoic acid CAS Name: 3-(1-methyl-3-indolyl)-2-(phenylmethoxycarbonylamino)propanoic acid IUPAC Name: 3-(1-methylindol-3-yl)-2-(phenylmethoxycarbonylamino)propanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-3-(1-methylindol-3-yl)propionic acid Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)CC(C(=O)O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)CC(C(=O)O)NC(=O)OCC3=CC=CC=C3

InChI

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