1-[(3-ethyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methyl-propan-2-yl-amino]-3-[(2-methylpropan-2-yl)oxy]propan-2-ol

Systemtic Name: 1-[(3-ethyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methyl-propan-2-yl-amino]-3-[(2-methylpropan-2-yl)oxy]propan-2-ol Openeye Name: 1-tert-butoxy-3-[(3-ethyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methyl-isopropyl-amino]propan-2-ol CAS Name: 1-[(3-ethyl-5-phenoxy-1-phenyl-4-pyrazolyl)methyl-propan-2-ylamino]-3-[(2-methylpropan-2-yl)oxy]-2-propanol IUPAC Name: 1-[(3-ethyl-5-phenoxy-1-phenylpyrazol-4-yl)methyl-propan-2-ylamino]-3-[(2-methylpropan-2-yl)oxy]propan-2-ol Traditional Name: 1-tert-butoxy-3-[(3-ethyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methyl-isopropyl-amino]propan-2-ol Formula: C28H39N3O3 MolecularWeight: 465.62756

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H39N3O3/c1-7-26-25(19-30(21(2)3)18-23(32)20-33-28(4,5)6)27(34-24-16-12-9-13-17-24)31(29-26)22-14-10-8-11-15-22/h8-17,21,23,32H,7,18-20H2,1-6H3