2,4-dinitro-1-[(E)-3-phenylprop-2-enyl]sulfanyl-benzene

Systemtic Name: 2,4-dinitro-1-[(E)-3-phenylprop-2-enyl]sulfanyl-benzene Openeye Name: 1-[(E)-cinnamyl]sulfanyl-2,4-dinitro-benzene CAS Name: 2,4-dinitro-1-[[(E)-3-phenylprop-2-enyl]thio]benzene IUPAC Name: 2,4-dinitro-1-[(E)-3-phenylprop-2-enyl]sulfanylbenzene Traditional Name: 1-[[(E)-cinnamyl]thio]-2,4-dinitro-benzene Formula: C15H12N2O4S MolecularWeight: 316.33178

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CCSC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)/C=C/CSC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H12N2O4S/c18-16(19)13-8-9-15(14(11-13)17(20)21)22-10-4-7-12-5-2-1-3-6-12/h1-9,11H,10H2/b7-4+