2-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]-4,5-bis(4-methoxyphenyl)pyrimidine

Systemtic Name: 2-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]-4,5-bis(4-methoxyphenyl)pyrimidine Openeye Name: 2-[1-[(3-fluorophenyl)methyl]-4-piperidyl]-4,5-bis(4-methoxyphenyl)pyrimidine CAS Name: 2-[1-[(3-fluorophenyl)methyl]-4-piperidinyl]-4,5-bis(4-methoxyphenyl)pyrimidine IUPAC Name: 2-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]-4,5-bis(4-methoxyphenyl)pyrimidine Traditional Name: 2-[1-(3-fluorobenzyl)-4-piperidyl]-4,5-bis(4-methoxyphenyl)pyrimidine Formula: C30H30FN3O2 MolecularWeight: 483.576503

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CN=C(N=C2C3=CC=C(C=C3)OC)C4CCN(CC4)CC5=CC(=CC=C5)F

Isomeric SMILES

COC1=CC=C(C=C1)C2=CN=C(N=C2C3=CC=C(C=C3)OC)C4CCN(CC4)CC5=CC(=CC=C5)F

InChI

InChI=1S/C30H30FN3O2/c1-35-26-10-6-22(7-11-26)28-19-32-30(33-29(28)23-8-12-27(36-2)13-9-23)24-14-16-34(17-15-24)20-21-4-3-5-25(31)18-21/h3-13,18-19,24H,14-17,20H2,1-2H3