2-[4-(2,4-dinitrophenoxy)-3-methoxy-phenyl]-1,3-dithiolane

Systemtic Name: 2-[4-(2,4-dinitrophenoxy)-3-methoxy-phenyl]-1,3-dithiolane Openeye Name: 2-[4-(2,4-dinitrophenoxy)-3-methoxy-phenyl]-1,3-dithiolane CAS Name: 2-[4-(2,4-dinitrophenoxy)-3-methoxyphenyl]-1,3-dithiolane IUPAC Name: 2-[4-(2,4-dinitrophenoxy)-3-methoxyphenyl]-1,3-dithiolane Traditional Name: 2-[4-(2,4-dinitrophenoxy)-3-methoxy-phenyl]-1,3-dithiolane Formula: C16H14N2O6S2 MolecularWeight: 394.42216

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2SCCS2)OC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)C2SCCS2)OC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H14N2O6S2/c1-23-15-8-10(16-25-6-7-26-16)2-4-14(15)24-13-5-3-11(17(19)20)9-12(13)18(21)22/h2-5,8-9,16H,6-7H2,1H3