2-[3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)piperidin-1-yl]-3-chloranyl-quinoxaline

Systemtic Name: 2-[3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)piperidin-1-yl]-3-chloranyl-quinoxaline Openeye Name: 2-[3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)-1-piperidyl]-3-chloro-quinoxaline CAS Name: 2-[3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)-1-piperidinyl]-3-chloroquinoxaline IUPAC Name: 2-[3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)piperidin-1-yl]-3-chloroquinoxaline Traditional Name: 2-[3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)piperidino]-3-chloro-quinoxaline Formula: C27H23ClFN3O3 MolecularWeight: 491.941223

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(C1C2=CC=C(C=C2)F)COC3=CC4=C(C=C3)OCO4)C5=NC6=CC=CC=C6N=C5Cl

Isomeric SMILES

C1CN(CC(C1C2=CC=C(C=C2)F)COC3=CC4=C(C=C3)OCO4)C5=NC6=CC=CC=C6N=C5Cl

InChI

InChI=1S/C27H23ClFN3O3/c28-26-27(31-23-4-2-1-3-22(23)30-26)32-12-11-21(17-5-7-19(29)8-6-17)18(14-32)15-33-20-9-10-24-25(13-20)35-16-34-24/h1-10,13,18,21H,11-12,14-16H2