5-(4-fluorophenyl)-4-[1-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperidin-3-yl]-2-methyl-pyrimidine

Systemtic Name: 5-(4-fluorophenyl)-4-[1-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperidin-3-yl]-2-methyl-pyrimidine Openeye Name: 5-(4-fluorophenyl)-4-[1-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3-piperidyl]-2-methyl-pyrimidine CAS Name: 5-(4-fluorophenyl)-4-[1-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3-piperidinyl]-2-methylpyrimidine IUPAC Name: 5-(4-fluorophenyl)-4-[1-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperidin-3-yl]-2-methylpyrimidine Traditional Name: 5-(4-fluorophenyl)-4-[1-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3-piperidyl]-2-methyl-pyrimidine Formula: C25H26FN3O3 MolecularWeight: 435.490643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=N1)C2CCCN(C2)CC3=CC4=C(C(=C3)OC)OCO4)C5=CC=C(C=C5)F

Isomeric SMILES

CC1=NC=C(C(=N1)C2CCCN(C2)CC3=CC4=C(C(=C3)OC)OCO4)C5=CC=C(C=C5)F

InChI

InChI=1S/C25H26FN3O3/c1-16-27-12-21(18-5-7-20(26)8-6-18)24(28-16)19-4-3-9-29(14-19)13-17-10-22(30-2)25-23(11-17)31-15-32-25/h5-8,10-12,19H,3-4,9,13-15H2,1-2H3