4-chloranyl-N-[4-oxidanylidene-4-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methylamino]butyl]benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=CC=C2CNC(=O)CCCNC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=CC=C2CNC(=O)CCCNC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H28ClN3O2/c24-21-11-9-18(10-12-21)23(29)25-13-5-8-22(28)26-16-19-6-1-2-7-20(19)17-27-14-3-4-15-27/h1-2,6-7,9-12H,3-5,8,13-17H2,(H,25,29)(H,26,28)/p+1