N-[5-chloranyl-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3,3-dimethyl-butanamide

Systemtic Name: N-[5-chloranyl-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3,3-dimethyl-butanamide Openeye Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3,3-dimethyl-butanamide CAS Name: N-[5-chloro-2-(4-methyl-1-piperazin-4-iumyl)phenyl]-3,3-dimethylbutanamide IUPAC Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3,3-dimethylbutanamide Traditional Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3,3-dimethyl-butyramide Formula: C17H27ClN3O+ MolecularWeight: 324.86878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)NC1=C(C=CC(=C1)Cl)N2CC[NH+](CC2)C

Isomeric SMILES

CC(C)(C)CC(=O)NC1=C(C=CC(=C1)Cl)N2CC[NH+](CC2)C

InChI

InChI=1S/C17H26ClN3O/c1-17(2,3)12-16(22)19-14-11-13(18)5-6-15(14)21-9-7-20(4)8-10-21/h5-6,11H,7-10,12H2,1-4H3,(H,19,22)/p+1