2-[4-[4-(pyridazin-4-ylamino)piperazin-1-yl]cyclohexyl]ethanoic acid

Systemtic Name: 2-[4-[4-(pyridazin-4-ylamino)piperazin-1-yl]cyclohexyl]ethanoic acid Openeye Name: 2-[4-[4-(pyridazin-4-ylamino)piperazin-1-yl]cyclohexyl]acetic acid CAS Name: 2-[4-[4-(4-pyridazinylamino)-1-piperazinyl]cyclohexyl]acetic acid IUPAC Name: 2-[4-[4-(pyridazin-4-ylamino)piperazin-1-yl]cyclohexyl]acetic acid Traditional Name: 2-[4-[4-(pyridazin-4-ylamino)piperazino]cyclohexyl]acetic acid Formula: C16H25N5O2 MolecularWeight: 319.402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CC(=O)O)N2CCN(CC2)NC3=CN=NC=C3

Isomeric SMILES

C1CC(CCC1CC(=O)O)N2CCN(CC2)NC3=CN=NC=C3

InChI

InChI=1S/C16H25N5O2/c22-16(23)11-13-1-3-15(4-2-13)20-7-9-21(10-8-20)19-14-5-6-17-18-12-14/h5-6,12-13,15H,1-4,7-11H2,(H,17,19)(H,22,23)