N-(4-azanyl-2-chloranyl-phenyl)-3-piperidin-1-ium-1-yl-propanamide

Systemtic Name: N-(4-azanyl-2-chloranyl-phenyl)-3-piperidin-1-ium-1-yl-propanamide Openeye Name: N-(4-amino-2-chloro-phenyl)-3-piperidin-1-ium-1-yl-propanamide CAS Name: N-(4-amino-2-chlorophenyl)-3-(1-piperidin-1-iumyl)propanamide IUPAC Name: N-(4-amino-2-chlorophenyl)-3-piperidin-1-ium-1-ylpropanamide Traditional Name: N-(4-amino-2-chloro-phenyl)-3-piperidin-1-ium-1-yl-propionamide Formula: C14H21ClN3O+ MolecularWeight: 282.78904

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCC(=O)NC2=C(C=C(C=C2)N)Cl

Isomeric SMILES

C1CC[NH+](CC1)CCC(=O)NC2=C(C=C(C=C2)N)Cl

InChI

InChI=1S/C14H20ClN3O/c15-12-10-11(16)4-5-13(12)17-14(19)6-9-18-7-2-1-3-8-18/h4-5,10H,1-3,6-9,16H2,(H,17,19)/p+1