2-[(3-nitrophenyl)methylsulfonyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole

Systemtic Name: 2-[(3-nitrophenyl)methylsulfonyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole Openeye Name: 2-[(3-nitrophenyl)methylsulfonyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole CAS Name: 2-[(3-nitrophenyl)methylsulfonyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole IUPAC Name: 2-[(3-nitrophenyl)methylsulfonyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole Traditional Name: 2-(3-nitrobenzyl)sulfonyl-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole Formula: C18H17N3O8S MolecularWeight: 435.40788

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NN=C(O2)S(=O)(=O)CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NN=C(O2)S(=O)(=O)CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O8S/c1-26-14-8-12(9-15(27-2)16(14)28-3)17-19-20-18(29-17)30(24,25)10-11-5-4-6-13(7-11)21(22)23/h4-9H,10H2,1-3H3