2-methyl-4-(methylamino)-5-nitro-1-phenyl-pentan-1-one

Systemtic Name: 2-methyl-4-(methylamino)-5-nitro-1-phenyl-pentan-1-one Openeye Name: 2-methyl-4-(methylamino)-5-nitro-1-phenyl-pentan-1-one CAS Name: 2-methyl-4-(methylamino)-5-nitro-1-phenyl-1-pentanone IUPAC Name: 2-methyl-4-(methylamino)-5-nitro-1-phenylpentan-1-one Traditional Name: 2-methyl-4-(methylamino)-5-nitro-1-phenyl-pentan-1-one Formula: C13H18N2O3 MolecularWeight: 250.29362

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O3/c1-10(8-12(14-2)9-15(17)18)13(16)11-6-4-3-5-7-11/h3-7,10,12,14H,8-9H2,1-2H3