1-(4-Methylphenylsulfonyl)-2-(4-nitrophenyl)ethylene; (E)-form 

AlkaPlorer ID: AK306238

Synonym: None

IUPAC Name: 1-methyl-4-[(E)-2-(4-nitrophenyl)ethenyl]sulfonylbenzene

Structure

SMILES: CC1=CC=C(S(=O)(=O)/C=C/C2=CC=C([N+](=O)[O-])C=C2)C=C1

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InChI: InChI=1S/C15H13NO4S/c1-12-2-8-15(9-3-12)21(19,20)11-10-13-4-6-14(7-5-13)16(17)18/h2-11H,1H3/b11-10+

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InChIKey: ODJRCTMFGQXBPT-ZHACJKMWSA-N

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Reference

PubChem CID: 13873807

CAS: 40807-10-1

Source

Properties Information

Molecule Weight: 303.339

TPSA: 77.28

MolLogP: 3.3478200000000022

Number of H-Donors: 0

Number of H-Acceptors: 4

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information