N-[(2-nitro-3-phenyl-1-benzofuran-5-yl)methyl]piperidine-3-carboxamide

Systemtic Name: N-[(2-nitro-3-phenyl-1-benzofuran-5-yl)methyl]piperidine-3-carboxamide Openeye Name: N-[(2-nitro-3-phenyl-benzofuran-5-yl)methyl]piperidine-3-carboxamide CAS Name: N-[(2-nitro-3-phenyl-5-benzofuranyl)methyl]-3-piperidinecarboxamide IUPAC Name: N-[(2-nitro-3-phenyl-1-benzofuran-5-yl)methyl]piperidine-3-carboxamide Traditional Name: N-[(2-nitro-3-phenyl-benzofuran-5-yl)methyl]nipecotamide Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)C(=O)NCC2=CC3=C(C=C2)OC(=C3C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC(CNC1)C(=O)NCC2=CC3=C(C=C2)OC(=C3C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O4/c25-20(16-7-4-10-22-13-16)23-12-14-8-9-18-17(11-14)19(21(28-18)24(26)27)15-5-2-1-3-6-15/h1-3,5-6,8-9,11,16,22H,4,7,10,12-13H2,(H,23,25)