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

Systemtic Name: N-[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-piperidino-benzamide Formula: C25H21BrN4O4 MolecularWeight: 521.36264

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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=CC=CC=C5Br)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC4=C(C=C3)OC(=N4)C5=CC=CC=C5Br)[N+](=O)[O-]

InChI

InChI=1S/C25H21BrN4O4/c26-19-7-3-2-6-18(19)25-28-20-15-17(9-11-23(20)34-25)27-24(31)16-8-10-21(22(14-16)30(32)33)29-12-4-1-5-13-29/h2-3,6-11,14-15H,1,4-5,12-13H2,(H,27,31)