(Z)-2-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]-3-(5-nitro-2-oxidanidyl-phenyl)prop-2-enoate

Systemtic Name: (Z)-2-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]-3-(5-nitro-2-oxidanidyl-phenyl)prop-2-enoate Openeye Name: (Z)-2-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]-3-(5-nitro-2-oxido-phenyl)prop-2-enoate CAS Name: (Z)-2-[(5-ethyl-1,3,4-oxadiazol-2-yl)thio]-3-(5-nitro-2-oxidophenyl)-2-propenoate IUPAC Name: (Z)-2-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]-3-(5-nitro-2-oxidophenyl)prop-2-enoate Traditional Name: (Z)-2-[(5-ethyl-1,3,4-oxadiazol-2-yl)thio]-3-(5-nitro-2-oxido-phenyl)acrylate Formula: C13H9N3O6S-2 MolecularWeight: 335.29206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11N3O6S/c1-2-11-14-15-13(22-11)23-10(12(18)19)6-7-5-8(16(20)21)3-4-9(7)17/h3-6,17H,2H2,1H3,(H,18,19)/p-2/b10-6-