1-[(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methyl]-4-oxidanylidene-piperidine-3-carboxylic acid

Systemtic Name: 1-[(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methyl]-4-oxidanylidene-piperidine-3-carboxylic acid Openeye Name: 1-[(7-methoxytetralin-2-yl)methyl]-4-oxo-piperidine-3-carboxylic acid CAS Name: 1-[(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methyl]-4-oxo-3-piperidinecarboxylic acid IUPAC Name: 1-[(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methyl]-4-oxopiperidine-3-carboxylic acid Traditional Name: 4-keto-1-[(7-methoxytetralin-2-yl)methyl]nipecotic acid Formula: C18H23NO4 MolecularWeight: 317.37952

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CCC(C2)CN3CCC(=O)C(C3)C(=O)O)C=C1

Isomeric SMILES

COC1=CC2=C(CCC(C2)CN3CCC(=O)C(C3)C(=O)O)C=C1

InChI

InChI=1S/C18H23NO4/c1-23-15-5-4-13-3-2-12(8-14(13)9-15)10-19-7-6-17(20)16(11-19)18(21)22/h4-5,9,12,16H,2-3,6-8,10-11H2,1H3,(H,21,22)