3-[1-(phenylmethyl)indol-3-yl]propanoic acid

Systemtic Name: 3-[1-(phenylmethyl)indol-3-yl]propanoic acid Openeye Name: 3-(1-benzylindol-3-yl)propanoic acid CAS Name: 3-[1-(phenylmethyl)-3-indolyl]propanoic acid IUPAC Name: 3-(1-benzylindol-3-yl)propanoic acid Traditional Name: 3-(1-benzylindol-3-yl)propionic acid Formula: C18H17NO2 MolecularWeight: 279.33308

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)CCC(=O)O

InChI

InChI=1S/C18H17NO2/c20-18(21)11-10-15-13-19(12-14-6-2-1-3-7-14)17-9-5-4-8-16(15)17/h1-9,13H,10-12H2,(H,20,21)