ethanamine; nitromethylsulfonylbenzene

Systemtic Name: ethanamine; nitromethylsulfonylbenzene Openeye Name: ethanamine; nitromethylsulfonylbenzene CAS Name: ethanamine; nitromethylsulfonylbenzene IUPAC Name: ethanamine; nitromethylsulfonylbenzene Traditional Name: ethylamine; nitromethylsulfonylbenzene Formula: C9H14N2O4S MolecularWeight: 246.28346

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H7NO4S.C2H7N/c9-8(10)6-13(11,12)7-4-2-1-3-5-7;1-2-3/h1-5H,6H2;2-3H2,1H3