N-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]-1-[(2R)-oxolan-2-yl]methanamine

Systemtic Name: N-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]-1-[(2R)-oxolan-2-yl]methanamine Openeye Name: N-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]-1-[(2R)-tetrahydrofuran-2-yl]methanamine CAS Name: N-[[1-methyl-3-(4-phenoxyphenyl)-4-pyrazolyl]methyl]-1-[(2R)-2-oxolanyl]methanamine IUPAC Name: N-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]-1-[(2R)-oxolan-2-yl]methanamine Traditional Name: [1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl-[[(2R)-tetrahydrofuran-2-yl]methyl]amine Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC=C(C=C2)OC3=CC=CC=C3)CNCC4CCCO4

Isomeric SMILES

CN1C=C(C(=N1)C2=CC=C(C=C2)OC3=CC=CC=C3)CNC[C@H]4CCCO4

InChI

InChI=1S/C22H25N3O2/c1-25-16-18(14-23-15-21-8-5-13-26-21)22(24-25)17-9-11-20(12-10-17)27-19-6-3-2-4-7-19/h2-4,6-7,9-12,16,21,23H,5,8,13-15H2,1H3/t21-/m1/s1