2-[4-fluoranyl-1-(piperazin-1-ylmethyl)-4-pyridin-2-yl-cyclohexa-2,5-dien-1-yl]ethanamine

Systemtic Name: 2-[4-fluoranyl-1-(piperazin-1-ylmethyl)-4-pyridin-2-yl-cyclohexa-2,5-dien-1-yl]ethanamine Openeye Name: 2-[4-fluoro-1-(piperazin-1-ylmethyl)-4-(2-pyridyl)cyclohexa-2,5-dien-1-yl]ethanamine CAS Name: 2-[4-fluoro-1-(1-piperazinylmethyl)-4-(2-pyridinyl)-1-cyclohexa-2,5-dienyl]ethanamine IUPAC Name: 2-[4-fluoro-1-(piperazin-1-ylmethyl)-4-pyridin-2-ylcyclohexa-2,5-dien-1-yl]ethanamine Traditional Name: 2-[4-fluoro-1-(piperazinomethyl)-4-(2-pyridyl)cyclohexa-2,5-dien-1-yl]ethylamine Formula: C18H25FN4 MolecularWeight: 316.416303

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CC2(C=CC(C=C2)(C3=CC=CC=N3)F)CCN

Isomeric SMILES

C1CN(CCN1)CC2(C=CC(C=C2)(C3=CC=CC=N3)F)CCN

InChI

InChI=1S/C18H25FN4/c19-18(16-3-1-2-10-22-16)6-4-17(5-7-18,8-9-20)15-23-13-11-21-12-14-23/h1-7,10,21H,8-9,11-15,20H2