1-(1,3-dinitropropan-2-yl)-4-methyl-benzene

Systemtic Name: 1-(1,3-dinitropropan-2-yl)-4-methyl-benzene Openeye Name: 1-methyl-4-[2-nitro-1-(nitromethyl)ethyl]benzene CAS Name: 1-(1,3-dinitropropan-2-yl)-4-methylbenzene IUPAC Name: 1-(1,3-dinitropropan-2-yl)-4-methylbenzene Traditional Name: 1-methyl-4-[2-nitro-1-(nitromethyl)ethyl]benzene Formula: C10H12N2O4 MolecularWeight: 224.21328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C[N+](=O)[O-])C[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(C[N+](=O)[O-])C[N+](=O)[O-]

InChI

InChI=1S/C10H12N2O4/c1-8-2-4-9(5-3-8)10(6-11(13)14)7-12(15)16/h2-5,10H,6-7H2,1H3