2-chloranyl-1,3-dinitro-5-propan-2-yl-benzene

Systemtic Name: 2-chloranyl-1,3-dinitro-5-propan-2-yl-benzene Openeye Name: 2-chloro-5-isopropyl-1,3-dinitro-benzene CAS Name: 2-chloro-1,3-dinitro-5-propan-2-ylbenzene IUPAC Name: 2-chloro-1,3-dinitro-5-propan-2-ylbenzene Traditional Name: 2-chloro-5-isopropyl-1,3-dinitro-benzene Formula: C9H9ClN2O4 MolecularWeight: 244.63176

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9ClN2O4/c1-5(2)6-3-7(11(13)14)9(10)8(4-6)12(15)16/h3-5H,1-2H3