1-[2-methoxyethyl-[[1-methyl-5-(4-methylphenoxy)-3-phenyl-pyrazol-4-yl]methyl]amino]hex-5-en-2-ol

Systemtic Name: 1-[2-methoxyethyl-[[1-methyl-5-(4-methylphenoxy)-3-phenyl-pyrazol-4-yl]methyl]amino]hex-5-en-2-ol Openeye Name: 1-[2-methoxyethyl-[[1-methyl-5-(4-methylphenoxy)-3-phenyl-pyrazol-4-yl]methyl]amino]hex-5-en-2-ol CAS Name: 1-[2-methoxyethyl-[[1-methyl-5-(4-methylphenoxy)-3-phenyl-4-pyrazolyl]methyl]amino]-5-hexen-2-ol IUPAC Name: 1-[2-methoxyethyl-[[1-methyl-5-(4-methylphenoxy)-3-phenylpyrazol-4-yl]methyl]amino]hex-5-en-2-ol Traditional Name: 1-[2-methoxyethyl-[[1-methyl-5-(4-methylphenoxy)-3-phenyl-pyrazol-4-yl]methyl]amino]hex-5-en-2-ol Formula: C27H35N3O3 MolecularWeight: 449.5851

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=C(C(=NN2C)C3=CC=CC=C3)CN(CCOC)CC(CCC=C)O

Isomeric SMILES

CC1=CC=C(C=C1)OC2=C(C(=NN2C)C3=CC=CC=C3)CN(CCOC)CC(CCC=C)O

InChI

InChI=1S/C27H35N3O3/c1-5-6-12-23(31)19-30(17-18-32-4)20-25-26(22-10-8-7-9-11-22)28-29(3)27(25)33-24-15-13-21(2)14-16-24/h5,7-11,13-16,23,31H,1,6,12,17-20H2,2-4H3