2-chloranyl-4-methyl-1,3-dinitro-5-propyl-benzene

Systemtic Name: 2-chloranyl-4-methyl-1,3-dinitro-5-propyl-benzene Openeye Name: 2-chloro-4-methyl-1,3-dinitro-5-propyl-benzene CAS Name: 2-chloro-4-methyl-1,3-dinitro-5-propylbenzene IUPAC Name: 2-chloro-4-methyl-1,3-dinitro-5-propylbenzene Traditional Name: 2-chloro-4-methyl-1,3-dinitro-5-propyl-benzene Formula: C10H11ClN2O4 MolecularWeight: 258.65834

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C(=C1C)[N+](=O)[O-])Cl)[N+](=O)[O-]

Isomeric SMILES

CCCC1=CC(=C(C(=C1C)[N+](=O)[O-])Cl)[N+](=O)[O-]

InChI

InChI=1S/C10H11ClN2O4/c1-3-4-7-5-8(12(14)15)9(11)10(6(7)2)13(16)17/h5H,3-4H2,1-2H3