1-(nitromethylsulfonyl)-4-propyl-benzene

Systemtic Name: 1-(nitromethylsulfonyl)-4-propyl-benzene Openeye Name: 1-(nitromethylsulfonyl)-4-propyl-benzene CAS Name: 1-(nitromethylsulfonyl)-4-propylbenzene IUPAC Name: 1-(nitromethylsulfonyl)-4-propylbenzene Traditional Name: 1-(nitromethylsulfonyl)-4-propyl-benzene Formula: C10H13NO4S MolecularWeight: 243.27952

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)C[N+](=O)[O-]

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)C[N+](=O)[O-]

InChI

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