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actinium; [5-[(E)-2-(4,5-dimethyl-2-oxidanyl-phenyl)ethenyl]-4-methyl-2-nitro-phenyl] ethanoate

actinium; [5-[(E)-2-(4,5-dimethyl-2-oxidanyl-phenyl)ethenyl]-4-methyl-2-nitro-phenyl] ethanoate

Systemtic Name:actinium; [5-[(E)-2-(4,5-dimethyl-2-oxidanyl-phenyl)ethenyl]-4-methyl-2-nitro-phenyl] ethanoate
Openeye Name:actinium; [5-[(E)-2-(2-hydroxy-4,5-dimethyl-phenyl)vinyl]-4-methyl-2-nitro-phenyl] acetate
CAS Name:acetic acid [5-[(E)-2-(2-hydroxy-4,5-dimethylphenyl)ethenyl]-4-methyl-2-nitrophenyl] ester; actinium
IUPAC Name:actinium; [5-[(E)-2-(2-hydroxy-4,5-dimethylphenyl)ethenyl]-4-methyl-2-nitrophenyl] acetate
Traditional Name:acetic acid [5-[(E)-2-(2-hydroxy-4,5-dimethyl-phenyl)vinyl]-4-methyl-2-nitro-phenyl] ester; actinium
Formula: C19H19AcNO5
MolecularWeight: 568.385607
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C=CC2=CC(=C(C=C2O)C)C)OC(=O)C)[N+](=O)[O-].[Ac]


Isomeric SMILES

CC1=CC(=C(C=C1/C=C/C2=CC(=C(C=C2O)C)C)OC(=O)C)[N+](=O)[O-].[Ac]


InChI

InChI=1S/C19H19NO5.Ac/c1-11-7-16(18(22)9-12(11)2)6-5-15-10-19(25-14(4)21)17(20(23)24)8-13(15)3;/h5-10,22H,1-4H3;/b6-5+;


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