4-nitro-4-phenyl-1-(3,4,5-trimethoxyphenyl)hexan-1-one

Systemtic Name: 4-nitro-4-phenyl-1-(3,4,5-trimethoxyphenyl)hexan-1-one Openeye Name: 4-nitro-4-phenyl-1-(3,4,5-trimethoxyphenyl)hexan-1-one CAS Name: 4-nitro-4-phenyl-1-(3,4,5-trimethoxyphenyl)-1-hexanone IUPAC Name: 4-nitro-4-phenyl-1-(3,4,5-trimethoxyphenyl)hexan-1-one Traditional Name: 4-nitro-4-phenyl-1-(3,4,5-trimethoxyphenyl)hexan-1-one Formula: C21H25NO6 MolecularWeight: 387.4263

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(=O)C1=CC(=C(C(=C1)OC)OC)OC)(C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCC(CCC(=O)C1=CC(=C(C(=C1)OC)OC)OC)(C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H25NO6/c1-5-21(22(24)25,16-9-7-6-8-10-16)12-11-17(23)15-13-18(26-2)20(28-4)19(14-15)27-3/h6-10,13-14H,5,11-12H2,1-4H3