4-[[3,5-bis(iodanyl)-2-prop-2-enoxy-phenyl]methylideneamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[[3,5-bis(iodanyl)-2-prop-2-enoxy-phenyl]methylideneamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[(2-allyloxy-3,5-diiodo-phenyl)methyleneamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[(3,5-diiodo-2-prop-2-enoxyphenyl)methylideneamino]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[(3,5-diiodo-2-prop-2-enoxyphenyl)methylideneamino]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[(2-allyloxy-3,5-diiodo-benzylidene)amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C21H19I2N3O2 MolecularWeight: 599.2034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=CC(=CC(=C3OCC=C)I)I

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=CC(=CC(=C3OCC=C)I)I

InChI

InChI=1S/C21H19I2N3O2/c1-4-10-28-20-15(11-16(22)12-18(20)23)13-24-19-14(2)25(3)26(21(19)27)17-8-6-5-7-9-17/h4-9,11-13H,1,10H2,2-3H3