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

Systemtic Name: 1-[(3-ethyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methyl-propyl-amino]hex-5-en-2-ol Openeye Name: 1-[(3-ethyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methyl-propyl-amino]hex-5-en-2-ol CAS Name: 1-[(3-ethyl-5-phenoxy-1-phenyl-4-pyrazolyl)methyl-propylamino]-5-hexen-2-ol IUPAC Name: 1-[(3-ethyl-5-phenoxy-1-phenylpyrazol-4-yl)methyl-propylamino]hex-5-en-2-ol Traditional Name: 1-[(3-ethyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methyl-propyl-amino]hex-5-en-2-ol Formula: C27H35N3O2 MolecularWeight: 433.5857

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H35N3O2/c1-4-7-16-23(31)20-29(19-5-2)21-25-26(6-3)28-30(22-14-10-8-11-15-22)27(25)32-24-17-12-9-13-18-24/h4,8-15,17-18,23,31H,1,5-7,16,19-21H2,2-3H3