N-[2-(dimethylamino)-2-thiophen-2-yl-ethyl]-1-(2-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: N-[2-(dimethylamino)-2-thiophen-2-yl-ethyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-[2-(dimethylamino)-2-(2-thienyl)ethyl]-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-[2-(dimethylamino)-2-(2-thienyl)ethyl]-1-(2-nitrophenyl)isonipecotamide Formula: C20H26N4O3S MolecularWeight: 402.51044

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1CCN(CC1)C2=CC=CC=C2[N+](=O)[O-])C3=CC=CS3

Isomeric SMILES

CN(C)C(CNC(=O)C1CCN(CC1)C2=CC=CC=C2[N+](=O)[O-])C3=CC=CS3

InChI

InChI=1S/C20H26N4O3S/c1-22(2)18(19-8-5-13-28-19)14-21-20(25)15-9-11-23(12-10-15)16-6-3-4-7-17(16)24(26)27/h3-8,13,15,18H,9-12,14H2,1-2H3,(H,21,25)