N-(5-chloranyl-2-methyl-phenyl)-4-ethyl-piperazin-4-ium-1-carboxamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-4-ethyl-piperazin-4-ium-1-carboxamide Openeye Name: N-(5-chloro-2-methyl-phenyl)-4-ethyl-piperazin-4-ium-1-carboxamide CAS Name: N-(5-chloro-2-methylphenyl)-4-ethyl-1-piperazin-4-iumcarboxamide IUPAC Name: N-(5-chloro-2-methylphenyl)-4-ethylpiperazin-4-ium-1-carboxamide Traditional Name: N-(5-chloro-2-methyl-phenyl)-4-ethyl-piperazin-4-ium-1-carboxamide Formula: C14H21ClN3O+ MolecularWeight: 282.78904

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)NC2=C(C=CC(=C2)Cl)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)NC2=C(C=CC(=C2)Cl)C

InChI

InChI=1S/C14H20ClN3O/c1-3-17-6-8-18(9-7-17)14(19)16-13-10-12(15)5-4-11(13)2/h4-5,10H,3,6-9H2,1-2H3,(H,16,19)/p+1