N-[4-(4-chloranylphenoxy)butyl]-4-ethyl-piperazin-4-ium-1-carboxamide

Systemtic Name: N-[4-(4-chloranylphenoxy)butyl]-4-ethyl-piperazin-4-ium-1-carboxamide Openeye Name: N-[4-(4-chlorophenoxy)butyl]-4-ethyl-piperazin-4-ium-1-carboxamide CAS Name: N-[4-(4-chlorophenoxy)butyl]-4-ethyl-1-piperazin-4-iumcarboxamide IUPAC Name: N-[4-(4-chlorophenoxy)butyl]-4-ethylpiperazin-4-ium-1-carboxamide Traditional Name: N-[4-(4-chlorophenoxy)butyl]-4-ethyl-piperazin-4-ium-1-carboxamide Formula: C17H27ClN3O2+ MolecularWeight: 340.86818

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)NCCCCOC2=CC=C(C=C2)Cl

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)NCCCCOC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H26ClN3O2/c1-2-20-10-12-21(13-11-20)17(22)19-9-3-4-14-23-16-7-5-15(18)6-8-16/h5-8H,2-4,9-14H2,1H3,(H,19,22)/p+1