N-[2,5-bis(chloranyl)phenyl]-4-(pyridin-2-ylmethyl)piperazin-4-ium-1-carboxamide

Systemtic Name: N-[2,5-bis(chloranyl)phenyl]-4-(pyridin-2-ylmethyl)piperazin-4-ium-1-carboxamide Openeye Name: N-(2,5-dichlorophenyl)-4-(2-pyridylmethyl)piperazin-4-ium-1-carboxamide CAS Name: N-(2,5-dichlorophenyl)-4-(2-pyridinylmethyl)-1-piperazin-4-iumcarboxamide IUPAC Name: N-(2,5-dichlorophenyl)-4-(pyridin-2-ylmethyl)piperazin-4-ium-1-carboxamide Traditional Name: N-(2,5-dichlorophenyl)-4-(2-pyridylmethyl)piperazin-4-ium-1-carboxamide Formula: C17H19Cl2N4O+ MolecularWeight: 366.26496

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=N2)C(=O)NC3=C(C=CC(=C3)Cl)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=N2)C(=O)NC3=C(C=CC(=C3)Cl)Cl

InChI

InChI=1S/C17H18Cl2N4O/c18-13-4-5-15(19)16(11-13)21-17(24)23-9-7-22(8-10-23)12-14-3-1-2-6-20-14/h1-6,11H,7-10,12H2,(H,21,24)/p+1