2-chloranyl-N-[3-oxidanylidene-3-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methylamino]propyl]benzamide

Systemtic Name: 2-chloranyl-N-[3-oxidanylidene-3-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methylamino]propyl]benzamide Openeye Name: 2-chloro-N-[3-oxo-3-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methylamino]propyl]benzamide CAS Name: 2-chloro-N-[3-oxo-3-[[4-(1-piperidin-1-iumylmethyl)phenyl]methylamino]propyl]benzamide IUPAC Name: 2-chloro-N-[3-oxo-3-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methylamino]propyl]benzamide Traditional Name: 2-chloro-N-[3-keto-3-[[4-(piperidin-1-ium-1-ylmethyl)benzyl]amino]propyl]benzamide Formula: C23H29ClN3O2+ MolecularWeight: 414.94826

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(C=C2)CNC(=O)CCNC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C=C2)CNC(=O)CCNC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C23H28ClN3O2/c24-21-7-3-2-6-20(21)23(29)25-13-12-22(28)26-16-18-8-10-19(11-9-18)17-27-14-4-1-5-15-27/h2-3,6-11H,1,4-5,12-17H2,(H,25,29)(H,26,28)/p+1