N-[3-chloranyl-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-ethyl-benzamide

Systemtic Name: N-[3-chloranyl-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-ethyl-benzamide Openeye Name: N-[3-chloro-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-ethyl-benzamide CAS Name: N-[3-chloro-4-(4-ethyl-1-piperazin-4-iumyl)phenyl]-4-ethylbenzamide IUPAC Name: N-[3-chloro-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-ethylbenzamide Traditional Name: N-[3-chloro-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-ethyl-benzamide Formula: C21H27ClN3O+ MolecularWeight: 372.91158

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CC[NH+](CC3)CC)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CC[NH+](CC3)CC)Cl

InChI

InChI=1S/C21H26ClN3O/c1-3-16-5-7-17(8-6-16)21(26)23-18-9-10-20(19(22)15-18)25-13-11-24(4-2)12-14-25/h5-10,15H,3-4,11-14H2,1-2H3,(H,23,26)/p+1