N-[2-(2-chloranyl-4-fluoranyl-phenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-[2-(2-chloranyl-4-fluoranyl-phenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-[2-(2-chloro-4-fluoro-phenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[2-(2-chloro-4-fluorophenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[2-(2-chloro-4-fluorophenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[2-(2-chloro-4-fluoro-phenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-piperidino-benzamide Formula: C25H20ClFN4O4 MolecularWeight: 494.902103

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC4=C(C=C3)OC(=N4)C5=C(C=C(C=C5)F)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC4=C(C=C3)OC(=N4)C5=C(C=C(C=C5)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C25H20ClFN4O4/c26-19-13-16(27)5-7-18(19)25-29-20-14-17(6-9-23(20)35-25)28-24(32)15-4-8-21(22(12-15)31(33)34)30-10-2-1-3-11-30/h4-9,12-14H,1-3,10-11H2,(H,28,32)