2-chloranyl-4-methyl-1,3-dinitro-5-prop-2-enyl-benzene

Systemtic Name: 2-chloranyl-4-methyl-1,3-dinitro-5-prop-2-enyl-benzene Openeye Name: 1-allyl-4-chloro-2-methyl-3,5-dinitro-benzene CAS Name: 2-chloro-4-methyl-1,3-dinitro-5-prop-2-enylbenzene IUPAC Name: 2-chloro-4-methyl-1,3-dinitro-5-prop-2-enylbenzene Traditional Name: 1-allyl-4-chloro-2-methyl-3,5-dinitro-benzene Formula: C10H9ClN2O4 MolecularWeight: 256.64246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1CC=C)[N+](=O)[O-])Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=C(C=C1CC=C)[N+](=O)[O-])Cl)[N+](=O)[O-]

InChI

InChI=1S/C10H9ClN2O4/c1-3-4-7-5-8(12(14)15)9(11)10(6(7)2)13(16)17/h3,5H,1,4H2,2H3