2-[4-(azepan-1-yl)-3-nitro-phenyl]-5-phenyl-1,3,4-oxadiazole

Systemtic Name: 2-[4-(azepan-1-yl)-3-nitro-phenyl]-5-phenyl-1,3,4-oxadiazole Openeye Name: 2-[4-(azepan-1-yl)-3-nitro-phenyl]-5-phenyl-1,3,4-oxadiazole CAS Name: 2-[4-(1-azepanyl)-3-nitrophenyl]-5-phenyl-1,3,4-oxadiazole IUPAC Name: 2-[4-(azepan-1-yl)-3-nitrophenyl]-5-phenyl-1,3,4-oxadiazole Traditional Name: 2-[4-(azepan-1-yl)-3-nitro-phenyl]-5-phenyl-1,3,4-oxadiazole Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)C3=NN=C(O3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)C3=NN=C(O3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O3/c25-24(26)18-14-16(10-11-17(18)23-12-6-1-2-7-13-23)20-22-21-19(27-20)15-8-4-3-5-9-15/h3-5,8-11,14H,1-2,6-7,12-13H2