2-chloranyl-4-methyl-1,3-dinitro-5-propan-2-yl-benzene

Systemtic Name: 2-chloranyl-4-methyl-1,3-dinitro-5-propan-2-yl-benzene Openeye Name: 4-chloro-1-isopropyl-2-methyl-3,5-dinitro-benzene CAS Name: 2-chloro-4-methyl-1,3-dinitro-5-propan-2-ylbenzene IUPAC Name: 2-chloro-4-methyl-1,3-dinitro-5-propan-2-ylbenzene Traditional Name: 4-chloro-1-isopropyl-2-methyl-3,5-dinitro-benzene Formula: C10H11ClN2O4 MolecularWeight: 258.65834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1C(C)C)[N+](=O)[O-])Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=C(C=C1C(C)C)[N+](=O)[O-])Cl)[N+](=O)[O-]

InChI

InChI=1S/C10H11ClN2O4/c1-5(2)7-4-8(12(14)15)9(11)10(6(7)3)13(16)17/h4-5H,1-3H3