3-(4-chlorophenyl)carbonyl-5-(4-nitrophenyl)carbonyl-heptane-2,6-dione

Systemtic Name: 3-(4-chlorophenyl)carbonyl-5-(4-nitrophenyl)carbonyl-heptane-2,6-dione Openeye Name: 3-(4-chlorobenzoyl)-5-(4-nitrobenzoyl)heptane-2,6-dione CAS Name: 3-[(4-chlorophenyl)-oxomethyl]-5-[(4-nitrophenyl)-oxomethyl]heptane-2,6-dione IUPAC Name: 3-(4-chlorobenzoyl)-5-(4-nitrobenzoyl)heptane-2,6-dione Traditional Name: 3-(4-chlorobenzoyl)-5-(4-nitrobenzoyl)heptane-2,6-dione Formula: C21H18ClNO6 MolecularWeight: 415.82372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18ClNO6/c1-12(24)18(20(26)14-3-7-16(22)8-4-14)11-19(13(2)25)21(27)15-5-9-17(10-6-15)23(28)29/h3-10,18-19H,11H2,1-2H3