3-[5-[4-(2-ethoxy-5-fluoranyl-phenyl)piperazin-1-yl]pentyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[5-[4-(2-ethoxy-5-fluoranyl-phenyl)piperazin-1-yl]pentyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[5-[4-(2-ethoxy-5-fluoro-phenyl)piperazin-1-yl]pentyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[5-[4-(2-ethoxy-5-fluorophenyl)-1-piperazinyl]pentyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[5-[4-(2-ethoxy-5-fluorophenyl)piperazin-1-yl]pentyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[5-[4-(2-ethoxy-5-fluoro-phenyl)piperazino]pentyl]-1,2,3-benzotriazin-4-one Formula: C24H30FN5O2 MolecularWeight: 439.525703

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)F)N2CCN(CC2)CCCCCN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

CCOC1=C(C=C(C=C1)F)N2CCN(CC2)CCCCCN3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C24H30FN5O2/c1-2-32-23-11-10-19(25)18-22(23)29-16-14-28(15-17-29)12-6-3-7-13-30-24(31)20-8-4-5-9-21(20)26-27-30/h4-5,8-11,18H,2-3,6-7,12-17H2,1H3