4-[3-[1-(6-chloranylpyridazin-3-yl)piperidin-4-yl]propyl]benzoic acid

Systemtic Name: 4-[3-[1-(6-chloranylpyridazin-3-yl)piperidin-4-yl]propyl]benzoic acid Openeye Name: 4-[3-[1-(6-chloropyridazin-3-yl)-4-piperidyl]propyl]benzoic acid CAS Name: 4-[3-[1-(6-chloro-3-pyridazinyl)-4-piperidinyl]propyl]benzoic acid IUPAC Name: 4-[3-[1-(6-chloropyridazin-3-yl)piperidin-4-yl]propyl]benzoic acid Traditional Name: 4-[3-[1-(6-chloropyridazin-3-yl)-4-piperidyl]propyl]benzoic acid Formula: C19H22ClN3O2 MolecularWeight: 359.84988

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCCC2=CC=C(C=C2)C(=O)O)C3=NN=C(C=C3)Cl

Isomeric SMILES

C1CN(CCC1CCCC2=CC=C(C=C2)C(=O)O)C3=NN=C(C=C3)Cl

InChI

InChI=1S/C19H22ClN3O2/c20-17-8-9-18(22-21-17)23-12-10-15(11-13-23)3-1-2-14-4-6-16(7-5-14)19(24)25/h4-9,15H,1-3,10-13H2,(H,24,25)