3-[3-[methyl(2-pyridin-4-ylethyl)amino]propoxy]benzoic acid

Systemtic Name: 3-[3-[methyl(2-pyridin-4-ylethyl)amino]propoxy]benzoic acid Openeye Name: 3-[3-[methyl-[2-(4-pyridyl)ethyl]amino]propoxy]benzoic acid CAS Name: 3-[3-[methyl(2-pyridin-4-ylethyl)amino]propoxy]benzoic acid IUPAC Name: 3-[3-[methyl(2-pyridin-4-ylethyl)amino]propoxy]benzoic acid Traditional Name: 3-[3-[methyl-[2-(4-pyridyl)ethyl]amino]propoxy]benzoic acid Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCOC1=CC=CC(=C1)C(=O)O)CCC2=CC=NC=C2

Isomeric SMILES

CN(CCCOC1=CC=CC(=C1)C(=O)O)CCC2=CC=NC=C2

InChI

InChI=1S/C18H22N2O3/c1-20(12-8-15-6-9-19-10-7-15)11-3-13-23-17-5-2-4-16(14-17)18(21)22/h2,4-7,9-10,14H,3,8,11-13H2,1H3,(H,21,22)