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

Systemtic Name: N-[2-(3-iodanylphenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-piperidino-benzamide Formula: C25H21IN4O4 MolecularWeight: 568.36311

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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=C5)I)[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=C5)I)[N+](=O)[O-]

InChI

InChI=1S/C25H21IN4O4/c26-18-6-4-5-17(13-18)25-28-20-15-19(8-10-23(20)34-25)27-24(31)16-7-9-21(22(14-16)30(32)33)29-11-2-1-3-12-29/h4-10,13-15H,1-3,11-12H2,(H,27,31)