(E)-2-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]-3-(4-nitrophenyl)prop-2-enoate

Systemtic Name: (E)-2-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]-3-(4-nitrophenyl)prop-2-enoate Openeye Name: (E)-2-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]-3-(4-nitrophenyl)prop-2-enoate CAS Name: (E)-2-[(5-ethyl-1,3,4-oxadiazol-2-yl)thio]-3-(4-nitrophenyl)-2-propenoate IUPAC Name: (E)-2-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]-3-(4-nitrophenyl)prop-2-enoate Traditional Name: (E)-2-[(5-ethyl-1,3,4-oxadiazol-2-yl)thio]-3-(4-nitrophenyl)acrylate Formula: C13H10N3O5S- MolecularWeight: 320.3006

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(O1)SC(=CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

CCC1=NN=C(O1)S/C(=C/C2=CC=C(C=C2)[N+](=O)[O-])/C(=O)[O-]

InChI

InChI=1S/C13H11N3O5S/c1-2-11-14-15-13(21-11)22-10(12(17)18)7-8-3-5-9(6-4-8)16(19)20/h3-7H,2H2,1H3,(H,17,18)/p-1/b10-7+