1-[(3-ethyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methyl-(oxolan-2-ylmethyl)amino]-2-methyl-but-3-en-2-ol

Systemtic Name: 1-[(3-ethyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methyl-(oxolan-2-ylmethyl)amino]-2-methyl-but-3-en-2-ol Openeye Name: 1-[(3-ethyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methyl-(tetrahydrofuran-2-ylmethyl)amino]-2-methyl-but-3-en-2-ol CAS Name: 1-[(3-ethyl-5-phenoxy-1-phenyl-4-pyrazolyl)methyl-(2-oxolanylmethyl)amino]-2-methyl-3-buten-2-ol IUPAC Name: 1-[(3-ethyl-5-phenoxy-1-phenylpyrazol-4-yl)methyl-(oxolan-2-ylmethyl)amino]-2-methylbut-3-en-2-ol Traditional Name: 1-[(3-ethyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methyl-(tetrahydrofurfuryl)amino]-2-methyl-but-3-en-2-ol Formula: C28H35N3O3 MolecularWeight: 461.5958

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1CN(CC2CCCO2)CC(C)(C=C)O)OC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCC1=NN(C(=C1CN(CC2CCCO2)CC(C)(C=C)O)OC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H35N3O3/c1-4-26-25(20-30(21-28(3,32)5-2)19-24-17-12-18-33-24)27(34-23-15-10-7-11-16-23)31(29-26)22-13-8-6-9-14-22/h5-11,13-16,24,32H,2,4,12,17-21H2,1,3H3