1-[[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-pyrazol-4-yl]methyl-(2-methylpropyl)amino]butan-2-ol

Systemtic Name: 1-[[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-pyrazol-4-yl]methyl-(2-methylpropyl)amino]butan-2-ol Openeye Name: 1-[[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-pyrazol-4-yl]methyl-isobutyl-amino]butan-2-ol CAS Name: 1-[[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-4-pyrazolyl]methyl-(2-methylpropyl)amino]-2-butanol IUPAC Name: 1-[[3-ethyl-5-(4-methoxyphenoxy)-1-phenylpyrazol-4-yl]methyl-(2-methylpropyl)amino]butan-2-ol Traditional Name: 1-[[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-pyrazol-4-yl]methyl-isobutyl-amino]butan-2-ol Formula: C27H37N3O3 MolecularWeight: 451.60098

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1CN(CC(C)C)CC(CC)O)OC2=CC=C(C=C2)OC)C3=CC=CC=C3

Isomeric SMILES

CCC1=NN(C(=C1CN(CC(C)C)CC(CC)O)OC2=CC=C(C=C2)OC)C3=CC=CC=C3

InChI

InChI=1S/C27H37N3O3/c1-6-22(31)18-29(17-20(3)4)19-25-26(7-2)28-30(21-11-9-8-10-12-21)27(25)33-24-15-13-23(32-5)14-16-24/h8-16,20,22,31H,6-7,17-19H2,1-5H3