5-[(4-chloranyl-2-nitro-phenoxy)methyl]-3-(phenylmethyl)-1,2,4-oxadiazole

Systemtic Name: 5-[(4-chloranyl-2-nitro-phenoxy)methyl]-3-(phenylmethyl)-1,2,4-oxadiazole Openeye Name: 3-benzyl-5-[(4-chloro-2-nitro-phenoxy)methyl]-1,2,4-oxadiazole CAS Name: 5-[(4-chloro-2-nitrophenoxy)methyl]-3-(phenylmethyl)-1,2,4-oxadiazole IUPAC Name: 3-benzyl-5-[(4-chloro-2-nitrophenoxy)methyl]-1,2,4-oxadiazole Traditional Name: 3-benzyl-5-[(4-chloro-2-nitro-phenoxy)methyl]-1,2,4-oxadiazole Formula: C16H12ClN3O4 MolecularWeight: 345.73718

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NOC(=N2)COC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=NOC(=N2)COC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H12ClN3O4/c17-12-6-7-14(13(9-12)20(21)22)23-10-16-18-15(19-24-16)8-11-4-2-1-3-5-11/h1-7,9H,8,10H2