1,2,4-trimethyl-3-(nitromethylsulfonyl)benzene

Systemtic Name: 1,2,4-trimethyl-3-(nitromethylsulfonyl)benzene Openeye Name: 1,2,4-trimethyl-3-(nitromethylsulfonyl)benzene CAS Name: 1,2,4-trimethyl-3-(nitromethylsulfonyl)benzene IUPAC Name: 1,2,4-trimethyl-3-(nitromethylsulfonyl)benzene Traditional Name: 1,2,4-trimethyl-3-(nitromethylsulfonyl)benzene Formula: C10H13NO4S MolecularWeight: 243.27952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H13NO4S/c1-7-4-5-8(2)10(9(7)3)16(14,15)6-11(12)13/h4-5H,6H2,1-3H3