2-chloranyl-N-[3-chloranyl-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]pyridine-3-carboxamide

Systemtic Name: 2-chloranyl-N-[3-chloranyl-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]pyridine-3-carboxamide Openeye Name: 2-chloro-N-[3-chloro-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]pyridine-3-carboxamide CAS Name: 2-chloro-N-[3-chloro-4-(4-ethyl-1-piperazin-4-iumyl)phenyl]-3-pyridinecarboxamide IUPAC Name: 2-chloro-N-[3-chloro-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]pyridine-3-carboxamide Traditional Name: 2-chloro-N-[3-chloro-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]nicotinamide Formula: C18H21Cl2N4O+ MolecularWeight: 380.29154

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=C(N=CC=C3)Cl)Cl

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=C(N=CC=C3)Cl)Cl

InChI

InChI=1S/C18H20Cl2N4O/c1-2-23-8-10-24(11-9-23)16-6-5-13(12-15(16)19)22-18(25)14-4-3-7-21-17(14)20/h3-7,12H,2,8-11H2,1H3,(H,22,25)/p+1