4-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-1-(2-methylpyrazol-3-yl)-1-phenyl-butan-1-ol

Systemtic Name: 4-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-1-(2-methylpyrazol-3-yl)-1-phenyl-butan-1-ol Openeye Name: 4-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-1-(2-methylpyrazol-3-yl)-1-phenyl-butan-1-ol CAS Name: 4-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-1-(2-methyl-3-pyrazolyl)-1-phenyl-1-butanol IUPAC Name: 4-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-1-(2-methylpyrazol-3-yl)-1-phenylbutan-1-ol Traditional Name: 4-[homoveratryl(methyl)amino]-1-(2-methylpyrazol-3-yl)-1-phenyl-butan-1-ol Formula: C25H33N3O3 MolecularWeight: 423.54782

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C(CCCN(C)CCC2=CC(=C(C=C2)OC)OC)(C3=CC=CC=C3)O

Isomeric SMILES

CN1C(=CC=N1)C(CCCN(C)CCC2=CC(=C(C=C2)OC)OC)(C3=CC=CC=C3)O

InChI

InChI=1S/C25H33N3O3/c1-27(18-14-20-11-12-22(30-3)23(19-20)31-4)17-8-15-25(29,21-9-6-5-7-10-21)24-13-16-26-28(24)2/h5-7,9-13,16,19,29H,8,14-15,17-18H2,1-4H3