2,6-dimethyl-4-(2-nitro-1-phenyl-ethyl)heptane-3,5-dione

Systemtic Name: 2,6-dimethyl-4-(2-nitro-1-phenyl-ethyl)heptane-3,5-dione Openeye Name: 2,6-dimethyl-4-(2-nitro-1-phenyl-ethyl)heptane-3,5-dione CAS Name: 2,6-dimethyl-4-(2-nitro-1-phenylethyl)heptane-3,5-dione IUPAC Name: 2,6-dimethyl-4-(2-nitro-1-phenylethyl)heptane-3,5-dione Traditional Name: 2,6-dimethyl-4-(2-nitro-1-phenyl-ethyl)heptane-3,5-dione Formula: C17H23NO4 MolecularWeight: 305.36882

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23NO4/c1-11(2)16(19)15(17(20)12(3)4)14(10-18(21)22)13-8-6-5-7-9-13/h5-9,11-12,14-15H,10H2,1-4H3