3-[3-(2,4-dinitrophenyl)sulfanylpropyl]pyridine

Systemtic Name: 3-[3-(2,4-dinitrophenyl)sulfanylpropyl]pyridine Openeye Name: 3-[3-(2,4-dinitrophenyl)sulfanylpropyl]pyridine CAS Name: 3-[3-[(2,4-dinitrophenyl)thio]propyl]pyridine IUPAC Name: 3-[3-(2,4-dinitrophenyl)sulfanylpropyl]pyridine Traditional Name: 3-[3-[(2,4-dinitrophenyl)thio]propyl]pyridine Formula: C14H13N3O4S MolecularWeight: 319.33572

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CCCSC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CN=C1)CCCSC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H13N3O4S/c18-16(19)12-5-6-14(13(9-12)17(20)21)22-8-2-4-11-3-1-7-15-10-11/h1,3,5-7,9-10H,2,4,8H2