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

Systemtic Name: (E)-2-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]-3-(4-methyl-3-nitro-phenyl)prop-2-enoate Openeye Name: (E)-2-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]-3-(4-methyl-3-nitro-phenyl)prop-2-enoate CAS Name: (E)-2-[(5-ethyl-1,3,4-oxadiazol-2-yl)thio]-3-(4-methyl-3-nitrophenyl)-2-propenoate IUPAC Name: (E)-2-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]-3-(4-methyl-3-nitrophenyl)prop-2-enoate Traditional Name: (E)-2-[(5-ethyl-1,3,4-oxadiazol-2-yl)thio]-3-(4-methyl-3-nitro-phenyl)acrylate Formula: C14H12N3O5S- MolecularWeight: 334.32718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13N3O5S/c1-3-12-15-16-14(22-12)23-11(13(18)19)7-9-5-4-8(2)10(6-9)17(20)21/h4-7H,3H2,1-2H3,(H,18,19)/p-1/b11-7+