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

Systemtic Name: N-[2-(5-bromanyl-2-chloranyl-phenyl)-1,3-benzoxazol-5-yl]-2-(4-methylpiperidin-1-yl)-5-nitro-benzamide Openeye Name: N-[2-(5-bromo-2-chloro-phenyl)-1,3-benzoxazol-5-yl]-2-(4-methyl-1-piperidyl)-5-nitro-benzamide CAS Name: N-[2-(5-bromo-2-chlorophenyl)-1,3-benzoxazol-5-yl]-2-(4-methyl-1-piperidinyl)-5-nitrobenzamide IUPAC Name: N-[2-(5-bromo-2-chlorophenyl)-1,3-benzoxazol-5-yl]-2-(4-methylpiperidin-1-yl)-5-nitrobenzamide Traditional Name: N-[2-(5-bromo-2-chloro-phenyl)-1,3-benzoxazol-5-yl]-2-(4-methylpiperidino)-5-nitro-benzamide Formula: C26H22BrClN4O4 MolecularWeight: 569.83428

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC4=C(C=C3)OC(=N4)C5=C(C=CC(=C5)Br)Cl

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC4=C(C=C3)OC(=N4)C5=C(C=CC(=C5)Br)Cl

InChI

InChI=1S/C26H22BrClN4O4/c1-15-8-10-31(11-9-15)23-6-4-18(32(34)35)14-20(23)25(33)29-17-3-7-24-22(13-17)30-26(36-24)19-12-16(27)2-5-21(19)28/h2-7,12-15H,8-11H2,1H3,(H,29,33)