4-azanyl-1-[2-(6-methoxyquinolin-4-yl)-2-oxidanyl-ethyl]piperidine-3-carboxylic acid

Systemtic Name: 4-azanyl-1-[2-(6-methoxyquinolin-4-yl)-2-oxidanyl-ethyl]piperidine-3-carboxylic acid Openeye Name: 4-amino-1-[2-hydroxy-2-(6-methoxy-4-quinolyl)ethyl]piperidine-3-carboxylic acid CAS Name: 4-amino-1-[2-hydroxy-2-(6-methoxy-4-quinolinyl)ethyl]-3-piperidinecarboxylic acid IUPAC Name: 4-amino-1-[2-hydroxy-2-(6-methoxyquinolin-4-yl)ethyl]piperidine-3-carboxylic acid Traditional Name: 4-amino-1-[2-hydroxy-2-(6-methoxy-4-quinolyl)ethyl]nipecotic acid Formula: C18H23N3O4 MolecularWeight: 345.39292

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1)C(CN3CCC(C(C3)C(=O)O)N)O

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1)C(CN3CCC(C(C3)C(=O)O)N)O

InChI

InChI=1S/C18H23N3O4/c1-25-11-2-3-16-13(8-11)12(4-6-20-16)17(22)10-21-7-5-15(19)14(9-21)18(23)24/h2-4,6,8,14-15,17,22H,5,7,9-10,19H2,1H3,(H,23,24)