4-chloranyl-N-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethyl]pyridine-2-carboxamide

Systemtic Name: 4-chloranyl-N-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethyl]pyridine-2-carboxamide Openeye Name: N-[2-(4-benzylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-4-chloro-pyridine-2-carboxamide CAS Name: 4-chloro-N-[2-oxo-2-[4-(phenylmethyl)-1-piperazin-4-iumyl]ethyl]-2-pyridinecarboxamide IUPAC Name: N-[2-(4-benzylpiperazin-4-ium-1-yl)-2-oxoethyl]-4-chloropyridine-2-carboxamide Traditional Name: N-[2-(4-benzylpiperazin-4-ium-1-yl)-2-keto-ethyl]-4-chloro-picolinamide Formula: C19H22ClN4O2+ MolecularWeight: 373.85658

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)CNC(=O)C3=NC=CC(=C3)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)CNC(=O)C3=NC=CC(=C3)Cl

InChI

InChI=1S/C19H21ClN4O2/c20-16-6-7-21-17(12-16)19(26)22-13-18(25)24-10-8-23(9-11-24)14-15-4-2-1-3-5-15/h1-7,12H,8-11,13-14H2,(H,22,26)/p+1