3-[(2,6-dimethylpiperidin-1-yl)methyl]-1-benzofuran-2-carboxylic acid

Systemtic Name: 3-[(2,6-dimethylpiperidin-1-yl)methyl]-1-benzofuran-2-carboxylic acid Openeye Name: 3-[(2,6-dimethyl-1-piperidyl)methyl]benzofuran-2-carboxylic acid CAS Name: 3-[(2,6-dimethyl-1-piperidinyl)methyl]-2-benzofurancarboxylic acid IUPAC Name: 3-[(2,6-dimethylpiperidin-1-yl)methyl]-1-benzofuran-2-carboxylic acid Traditional Name: 3-[(2,6-dimethylpiperidino)methyl]coumarilic acid Formula: C17H21NO3 MolecularWeight: 287.35354

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1CC2=C(OC3=CC=CC=C32)C(=O)O)C

Isomeric SMILES

CC1CCCC(N1CC2=C(OC3=CC=CC=C32)C(=O)O)C

InChI

InChI=1S/C17H21NO3/c1-11-6-5-7-12(2)18(11)10-14-13-8-3-4-9-15(13)21-16(14)17(19)20/h3-4,8-9,11-12H,5-7,10H2,1-2H3,(H,19,20)