1-(2-nitrophenyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)piperidine-4-carboxamide

Systemtic Name: 1-(2-nitrophenyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)piperidine-4-carboxamide Openeye Name: 1-(2-nitrophenyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)piperidine-4-carboxamide CAS Name: 1-(2-nitrophenyl)-N-[2-(1-pyrrolidin-1-iumyl)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(2-nitrophenyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)piperidine-4-carboxamide Traditional Name: 1-(2-nitrophenyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)isonipecotamide Formula: C18H27N4O3+ MolecularWeight: 347.43198

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCNC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CC[NH+](C1)CCNC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H26N4O3/c23-18(19-9-14-20-10-3-4-11-20)15-7-12-21(13-8-15)16-5-1-2-6-17(16)22(24)25/h1-2,5-6,15H,3-4,7-14H2,(H,19,23)/p+1