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1-[quinolin-2-yl(quinolin-3-yl)methyl]piperidine-4-carboxylic acid

1-[quinolin-2-yl(quinolin-3-yl)methyl]piperidine-4-carboxylic acid

Systemtic Name:1-[quinolin-2-yl(quinolin-3-yl)methyl]piperidine-4-carboxylic acid
Openeye Name:1-[2-quinolyl(3-quinolyl)methyl]piperidine-4-carboxylic acid
CAS Name:1-[2-quinolinyl(3-quinolinyl)methyl]-4-piperidinecarboxylic acid
IUPAC Name:1-[quinolin-2-yl(quinolin-3-yl)methyl]piperidine-4-carboxylic acid
Traditional Name:1-[2-quinolyl(3-quinolyl)methyl]isonipecotic acid
Formula: C25H23N3O2
MolecularWeight: 397.46902
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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(C2=NC3=CC=CC=C3C=C2)C4=CC5=CC=CC=C5N=C4


Isomeric SMILES

C1CN(CCC1C(=O)O)C(C2=NC3=CC=CC=C3C=C2)C4=CC5=CC=CC=C5N=C4


InChI

InChI=1S/C25H23N3O2/c29-25(30)18-11-13-28(14-12-18)24(20-15-19-6-2-3-7-21(19)26-16-20)23-10-9-17-5-1-4-8-22(17)27-23/h1-10,15-16,18,24H,11-14H2,(H,29,30)


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