2-[4-[2-oxidanylidene-2-[(1-piperidin-4-ylimidazol-4-yl)amino]ethyl]piperidin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[2-oxidanylidene-2-[(1-piperidin-4-ylimidazol-4-yl)amino]ethyl]piperidin-1-yl]ethanoic acid Openeye Name: 2-[4-[2-oxo-2-[[1-(4-piperidyl)imidazol-4-yl]amino]ethyl]-1-piperidyl]acetic acid CAS Name: 2-[4-[2-oxo-2-[[1-(4-piperidinyl)-4-imidazolyl]amino]ethyl]-1-piperidinyl]acetic acid IUPAC Name: 2-[4-[2-oxo-2-[(1-piperidin-4-ylimidazol-4-yl)amino]ethyl]piperidin-1-yl]acetic acid Traditional Name: 2-[4-[2-keto-2-[[1-(4-piperidyl)imidazol-4-yl]amino]ethyl]piperidino]acetic acid Formula: C17H27N5O3 MolecularWeight: 349.42798

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1N2C=C(N=C2)NC(=O)CC3CCN(CC3)CC(=O)O

Isomeric SMILES

C1CNCCC1N2C=C(N=C2)NC(=O)CC3CCN(CC3)CC(=O)O

InChI

InChI=1S/C17H27N5O3/c23-16(9-13-3-7-21(8-4-13)11-17(24)25)20-15-10-22(12-19-15)14-1-5-18-6-2-14/h10,12-14,18H,1-9,11H2,(H,20,23)(H,24,25)