3-[3-(2-methylpiperidin-1-yl)propyl]-1-benzofuran-2-carboxylic acid

Systemtic Name: 3-[3-(2-methylpiperidin-1-yl)propyl]-1-benzofuran-2-carboxylic acid Openeye Name: 3-[3-(2-methyl-1-piperidyl)propyl]benzofuran-2-carboxylic acid CAS Name: 3-[3-(2-methyl-1-piperidinyl)propyl]-2-benzofurancarboxylic acid IUPAC Name: 3-[3-(2-methylpiperidin-1-yl)propyl]-1-benzofuran-2-carboxylic acid Traditional Name: 3-[3-(2-methylpiperidino)propyl]coumarilic acid Formula: C18H23NO3 MolecularWeight: 301.38012

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CCCC2=C(OC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC1CCCCN1CCCC2=C(OC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C18H23NO3/c1-13-7-4-5-11-19(13)12-6-9-15-14-8-2-3-10-16(14)22-17(15)18(20)21/h2-3,8,10,13H,4-7,9,11-12H2,1H3,(H,20,21)