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

Systemtic Name: 3-chloranyl-4-ethoxy-N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]benzamide Openeye Name: 3-chloro-4-ethoxy-N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]benzamide CAS Name: 3-chloro-4-ethoxy-N-[4-(4-ethyl-1-piperazin-4-iumyl)phenyl]benzamide IUPAC Name: 3-chloro-4-ethoxy-N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]benzamide Traditional Name: 3-chloro-4-ethoxy-N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]benzamide Formula: C21H27ClN3O2+ MolecularWeight: 388.91098

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)OCC)Cl

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)OCC)Cl

InChI

InChI=1S/C21H26ClN3O2/c1-3-24-11-13-25(14-12-24)18-8-6-17(7-9-18)23-21(26)16-5-10-20(27-4-2)19(22)15-16/h5-10,15H,3-4,11-14H2,1-2H3,(H,23,26)/p+1