2-[4-[4-[2-(pyridin-4-ylamino)ethyl]piperazin-1-yl]piperidin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[4-[2-(pyridin-4-ylamino)ethyl]piperazin-1-yl]piperidin-1-yl]ethanoic acid Openeye Name: 2-[4-[4-[2-(4-pyridylamino)ethyl]piperazin-1-yl]-1-piperidyl]acetic acid CAS Name: 2-[4-[4-[2-(pyridin-4-ylamino)ethyl]-1-piperazinyl]-1-piperidinyl]acetic acid IUPAC Name: 2-[4-[4-[2-(pyridin-4-ylamino)ethyl]piperazin-1-yl]piperidin-1-yl]acetic acid Traditional Name: 2-[4-[4-[2-(4-pyridylamino)ethyl]piperazino]piperidino]acetic acid Formula: C18H29N5O2 MolecularWeight: 347.45516

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2CCN(CC2)CCNC3=CC=NC=C3)CC(=O)O

Isomeric SMILES

C1CN(CCC1N2CCN(CC2)CCNC3=CC=NC=C3)CC(=O)O

InChI

InChI=1S/C18H29N5O2/c24-18(25)15-22-8-3-17(4-9-22)23-13-11-21(12-14-23)10-7-20-16-1-5-19-6-2-16/h1-2,5-6,17H,3-4,7-15H2,(H,19,20)(H,24,25)