3-[3-(2-imidazol-1-ylethyl)-2,3-dihydroindol-1-yl]propanoic acid

Systemtic Name: 3-[3-(2-imidazol-1-ylethyl)-2,3-dihydroindol-1-yl]propanoic acid Openeye Name: 3-[3-(2-imidazol-1-ylethyl)indolin-1-yl]propanoic acid CAS Name: 3-[3-[2-(1-imidazolyl)ethyl]-2,3-dihydroindol-1-yl]propanoic acid IUPAC Name: 3-[3-(2-imidazol-1-ylethyl)-2,3-dihydroindol-1-yl]propanoic acid Traditional Name: 3-[3-(2-imidazol-1-ylethyl)indolin-1-yl]propionic acid Formula: C16H19N3O2 MolecularWeight: 285.34096

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=CC=CC=C2N1CCC(=O)O)CCN3C=CN=C3

Isomeric SMILES

C1C(C2=CC=CC=C2N1CCC(=O)O)CCN3C=CN=C3

InChI

InChI=1S/C16H19N3O2/c20-16(21)6-9-19-11-13(5-8-18-10-7-17-12-18)14-3-1-2-4-15(14)19/h1-4,7,10,12-13H,5-6,8-9,11H2,(H,20,21)