1-[(5-chloranyl-2,3-dihydro-1-benzofuran-2-yl)carbonyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(5-chloranyl-2,3-dihydro-1-benzofuran-2-yl)carbonyl]piperidine-4-carboxylic acid Openeye Name: 1-(5-chloro-2,3-dihydrobenzofuran-2-carbonyl)piperidine-4-carboxylic acid CAS Name: 1-[(5-chloro-2,3-dihydrobenzofuran-2-yl)-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(5-chloro-2,3-dihydro-1-benzofuran-2-carbonyl)piperidine-4-carboxylic acid Traditional Name: 1-(5-chlorocoumaran-2-carbonyl)isonipecotic acid Formula: C15H16ClNO4 MolecularWeight: 309.74484

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(=O)C2CC3=C(O2)C=CC(=C3)Cl

Isomeric SMILES

C1CN(CCC1C(=O)O)C(=O)C2CC3=C(O2)C=CC(=C3)Cl

InChI

InChI=1S/C15H16ClNO4/c16-11-1-2-12-10(7-11)8-13(21-12)14(18)17-5-3-9(4-6-17)15(19)20/h1-2,7,9,13H,3-6,8H2,(H,19,20)