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

Systemtic Name: 4-(4-chlorophenyl)-4-nitro-1-(3,4,5-trimethoxyphenyl)hexan-1-one Openeye Name: 4-(4-chlorophenyl)-4-nitro-1-(3,4,5-trimethoxyphenyl)hexan-1-one CAS Name: 4-(4-chlorophenyl)-4-nitro-1-(3,4,5-trimethoxyphenyl)-1-hexanone IUPAC Name: 4-(4-chlorophenyl)-4-nitro-1-(3,4,5-trimethoxyphenyl)hexan-1-one Traditional Name: 4-(4-chlorophenyl)-4-nitro-1-(3,4,5-trimethoxyphenyl)hexan-1-one Formula: C21H24ClNO6 MolecularWeight: 421.87136

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24ClNO6/c1-5-21(23(25)26,15-6-8-16(22)9-7-15)11-10-17(24)14-12-18(27-2)20(29-4)19(13-14)28-3/h6-9,12-13H,5,10-11H2,1-4H3