N-hexa-1,5-dien-3-yl-N-sulfanyl-nitramide; trichloromethylbenzene

Systemtic Name: N-hexa-1,5-dien-3-yl-N-sulfanyl-nitramide; trichloromethylbenzene Openeye Name: N-sulfanyl-N-(1-vinylbut-3-enyl)nitramide; trichloromethylbenzene CAS Name: N-hexa-1,5-dien-3-yl-N-mercaptonitramide; trichloromethylbenzene IUPAC Name: N-hexa-1,5-dien-3-yl-N-sulfanylnitramide; trichloromethylbenzene Traditional Name: N-mercapto-N-(1-vinylbut-3-enyl)nitramide; trichloromethylbenzene Formula: C13H15Cl3N2O2S MolecularWeight: 369.6944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H5Cl3.C6H10N2O2S/c8-7(9,10)6-4-2-1-3-5-6;1-3-5-6(4-2)7(11)8(9)10/h1-5H;3-4,6,11H,1-2,5H2