1-[2-[4-(2-nitrophenyl)piperazin-1-ium-1-yl]ethanoyl]-N-phenyl-piperidine-4-carboxamide

Systemtic Name: 1-[2-[4-(2-nitrophenyl)piperazin-1-ium-1-yl]ethanoyl]-N-phenyl-piperidine-4-carboxamide Openeye Name: 1-[2-[4-(2-nitrophenyl)piperazin-1-ium-1-yl]acetyl]-N-phenyl-piperidine-4-carboxamide CAS Name: 1-[2-[4-(2-nitrophenyl)-1-piperazin-1-iumyl]-1-oxoethyl]-N-phenyl-4-piperidinecarboxamide IUPAC Name: 1-[2-[4-(2-nitrophenyl)piperazin-1-ium-1-yl]acetyl]-N-phenylpiperidine-4-carboxamide Traditional Name: 1-[2-[4-(2-nitrophenyl)piperazin-1-ium-1-yl]acetyl]-N-phenyl-isonipecotamide Formula: C24H30N5O4+ MolecularWeight: 452.5261

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=CC=C2)C(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=CC=C2)C(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C24H29N5O4/c30-23(28-12-10-19(11-13-28)24(31)25-20-6-2-1-3-7-20)18-26-14-16-27(17-15-26)21-8-4-5-9-22(21)29(32)33/h1-9,19H,10-18H2,(H,25,31)/p+1