1-[[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-pyrazol-4-yl]methyl-propyl-amino]hex-5-en-2-ol

Systemtic Name: 1-[[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-pyrazol-4-yl]methyl-propyl-amino]hex-5-en-2-ol Openeye Name: 1-[[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-pyrazol-4-yl]methyl-propyl-amino]hex-5-en-2-ol CAS Name: 1-[[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-4-pyrazolyl]methyl-propylamino]-5-hexen-2-ol IUPAC Name: 1-[[3-ethyl-5-(4-methoxyphenoxy)-1-phenylpyrazol-4-yl]methyl-propylamino]hex-5-en-2-ol Traditional Name: 1-[[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-pyrazol-4-yl]methyl-propyl-amino]hex-5-en-2-ol Formula: C28H37N3O3 MolecularWeight: 463.61168

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=C(N(N=C1CC)C2=CC=CC=C2)OC3=CC=C(C=C3)OC)CC(CCC=C)O

Isomeric SMILES

CCCN(CC1=C(N(N=C1CC)C2=CC=CC=C2)OC3=CC=C(C=C3)OC)CC(CCC=C)O

InChI

InChI=1S/C28H37N3O3/c1-5-8-14-23(32)20-30(19-6-2)21-26-27(7-3)29-31(22-12-10-9-11-13-22)28(26)34-25-17-15-24(33-4)16-18-25/h5,9-13,15-18,23,32H,1,6-8,14,19-21H2,2-4H3