N-(3-chloranyl-2-morpholin-4-yl-phenyl)-4-(piperidin-1-ium-1-ylmethyl)benzamide

Systemtic Name: N-(3-chloranyl-2-morpholin-4-yl-phenyl)-4-(piperidin-1-ium-1-ylmethyl)benzamide Openeye Name: N-(3-chloro-2-morpholino-phenyl)-4-(piperidin-1-ium-1-ylmethyl)benzamide CAS Name: N-[3-chloro-2-(4-morpholinyl)phenyl]-4-(1-piperidin-1-iumylmethyl)benzamide IUPAC Name: N-(3-chloro-2-morpholin-4-ylphenyl)-4-(piperidin-1-ium-1-ylmethyl)benzamide Traditional Name: N-(3-chloro-2-morpholino-phenyl)-4-(piperidin-1-ium-1-ylmethyl)benzamide Formula: C23H29ClN3O2+ MolecularWeight: 414.94826

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(C=C2)C(=O)NC3=C(C(=CC=C3)Cl)N4CCOCC4

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C=C2)C(=O)NC3=C(C(=CC=C3)Cl)N4CCOCC4

InChI

InChI=1S/C23H28ClN3O2/c24-20-5-4-6-21(22(20)27-13-15-29-16-14-27)25-23(28)19-9-7-18(8-10-19)17-26-11-2-1-3-12-26/h4-10H,1-3,11-17H2,(H,25,28)/p+1