4-[1-(phenylmethyl)piperidin-4-yl]oxyquinoline-2-carboxylic acid

Systemtic Name: 4-[1-(phenylmethyl)piperidin-4-yl]oxyquinoline-2-carboxylic acid Openeye Name: 4-[(1-benzyl-4-piperidyl)oxy]quinoline-2-carboxylic acid CAS Name: 4-[[1-(phenylmethyl)-4-piperidinyl]oxy]-2-quinolinecarboxylic acid IUPAC Name: 4-(1-benzylpiperidin-4-yl)oxyquinoline-2-carboxylic acid Traditional Name: 4-[(1-benzyl-4-piperidyl)oxy]quinaldic acid Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC2=CC(=NC3=CC=CC=C32)C(=O)O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1OC2=CC(=NC3=CC=CC=C32)C(=O)O)CC4=CC=CC=C4

InChI

InChI=1S/C22H22N2O3/c25-22(26)20-14-21(18-8-4-5-9-19(18)23-20)27-17-10-12-24(13-11-17)15-16-6-2-1-3-7-16/h1-9,14,17H,10-13,15H2,(H,25,26)