1-nitrohexadecylsulfonylbenzene

Systemtic Name: 1-nitrohexadecylsulfonylbenzene Openeye Name: 1-nitrohexadecylsulfonylbenzene CAS Name: 1-nitrohexadecylsulfonylbenzene IUPAC Name: 1-nitrohexadecylsulfonylbenzene Traditional Name: 1-nitrohexadecylsulfonylbenzene Formula: C22H37NO4S MolecularWeight: 411.59848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H37NO4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-20-22(23(24)25)28(26,27)21-18-15-14-16-19-21/h14-16,18-19,22H,2-13,17,20H2,1H3