1-[[1-methyl-5-(4-methylphenoxy)-3-phenyl-pyrazol-4-yl]methyl-propan-2-yl-amino]-3-prop-2-enoxy-propan-2-ol

Systemtic Name: 1-[[1-methyl-5-(4-methylphenoxy)-3-phenyl-pyrazol-4-yl]methyl-propan-2-yl-amino]-3-prop-2-enoxy-propan-2-ol Openeye Name: 1-allyloxy-3-[isopropyl-[[1-methyl-5-(4-methylphenoxy)-3-phenyl-pyrazol-4-yl]methyl]amino]propan-2-ol CAS Name: 1-[[1-methyl-5-(4-methylphenoxy)-3-phenyl-4-pyrazolyl]methyl-propan-2-ylamino]-3-prop-2-enoxy-2-propanol IUPAC Name: 1-[[1-methyl-5-(4-methylphenoxy)-3-phenylpyrazol-4-yl]methyl-propan-2-ylamino]-3-prop-2-enoxypropan-2-ol Traditional Name: 1-allyloxy-3-[isopropyl-[[1-methyl-5-(4-methylphenoxy)-3-phenyl-pyrazol-4-yl]methyl]amino]propan-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(CC(COCC=C)O)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C27H35N3O3/c1-6-16-32-19-23(31)17-30(20(2)3)18-25-26(22-10-8-7-9-11-22)28-29(5)27(25)33-24-14-12-21(4)13-15-24/h6-15,20,23,31H,1,16-19H2,2-5H3