1-(3,4-dimethoxyphenyl)-4-methyl-4-nitro-pentan-1-one

Systemtic Name: 1-(3,4-dimethoxyphenyl)-4-methyl-4-nitro-pentan-1-one Openeye Name: 1-(3,4-dimethoxyphenyl)-4-methyl-4-nitro-pentan-1-one CAS Name: 1-(3,4-dimethoxyphenyl)-4-methyl-4-nitro-1-pentanone IUPAC Name: 1-(3,4-dimethoxyphenyl)-4-methyl-4-nitropentan-1-one Traditional Name: 1-(3,4-dimethoxyphenyl)-4-methyl-4-nitro-pentan-1-one Formula: C14H19NO5 MolecularWeight: 281.30436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC(=O)C1=CC(=C(C=C1)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)(CCC(=O)C1=CC(=C(C=C1)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C14H19NO5/c1-14(2,15(17)18)8-7-11(16)10-5-6-12(19-3)13(9-10)20-4/h5-6,9H,7-8H2,1-4H3