3-[2-methyl-3-(pyridin-3-ylmethyl)indol-1-yl]propanoic acid

Systemtic Name: 3-[2-methyl-3-(pyridin-3-ylmethyl)indol-1-yl]propanoic acid Openeye Name: 3-[2-methyl-3-(3-pyridylmethyl)indol-1-yl]propanoic acid CAS Name: 3-[2-methyl-3-(3-pyridinylmethyl)-1-indolyl]propanoic acid IUPAC Name: 3-[2-methyl-3-(pyridin-3-ylmethyl)indol-1-yl]propanoic acid Traditional Name: 3-[2-methyl-3-(3-pyridylmethyl)indol-1-yl]propionic acid Formula: C18H18N2O2 MolecularWeight: 294.34772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1CCC(=O)O)CC3=CN=CC=C3

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1CCC(=O)O)CC3=CN=CC=C3

InChI

InChI=1S/C18H18N2O2/c1-13-16(11-14-5-4-9-19-12-14)15-6-2-3-7-17(15)20(13)10-8-18(21)22/h2-7,9,12H,8,10-11H2,1H3,(H,21,22)