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

Systemtic Name: 4-(3,4-dichlorophenyl)-4-nitro-1-(3,4,5-trimethoxyphenyl)hexan-1-one Openeye Name: 4-(3,4-dichlorophenyl)-4-nitro-1-(3,4,5-trimethoxyphenyl)hexan-1-one CAS Name: 4-(3,4-dichlorophenyl)-4-nitro-1-(3,4,5-trimethoxyphenyl)-1-hexanone IUPAC Name: 4-(3,4-dichlorophenyl)-4-nitro-1-(3,4,5-trimethoxyphenyl)hexan-1-one Traditional Name: 4-(3,4-dichlorophenyl)-4-nitro-1-(3,4,5-trimethoxyphenyl)hexan-1-one Formula: C21H23Cl2NO6 MolecularWeight: 456.31642

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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)Cl)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C21H23Cl2NO6/c1-5-21(24(26)27,14-6-7-15(22)16(23)12-14)9-8-17(25)13-10-18(28-2)20(30-4)19(11-13)29-3/h6-7,10-12H,5,8-9H2,1-4H3