N-[3-chloranyl-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-methyl-propanamide

Systemtic Name: N-[3-chloranyl-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-methyl-propanamide Openeye Name: N-[3-chloro-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-methyl-propanamide CAS Name: N-[3-chloro-4-(4-ethyl-1-piperazin-4-iumyl)phenyl]-2-methylpropanamide IUPAC Name: N-[3-chloro-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-methylpropanamide Traditional Name: N-[3-chloro-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2-methyl-propionamide Formula: C16H25ClN3O+ MolecularWeight: 310.8422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24ClN3O/c1-4-19-7-9-20(10-8-19)15-6-5-13(11-14(15)17)18-16(21)12(2)3/h5-6,11-12H,4,7-10H2,1-3H3,(H,18,21)/p+1