N-(4-azanyl-2-chloranyl-phenyl)-3-[(2S)-2-methylpiperidin-1-ium-1-yl]propanamide

Systemtic Name: N-(4-azanyl-2-chloranyl-phenyl)-3-[(2S)-2-methylpiperidin-1-ium-1-yl]propanamide Openeye Name: N-(4-amino-2-chloro-phenyl)-3-[(2S)-2-methylpiperidin-1-ium-1-yl]propanamide CAS Name: N-(4-amino-2-chlorophenyl)-3-[(2S)-2-methyl-1-piperidin-1-iumyl]propanamide IUPAC Name: N-(4-amino-2-chlorophenyl)-3-[(2S)-2-methylpiperidin-1-ium-1-yl]propanamide Traditional Name: N-(4-amino-2-chloro-phenyl)-3-[(2S)-2-methylpiperidin-1-ium-1-yl]propionamide Formula: C15H23ClN3O+ MolecularWeight: 296.81562

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCC(=O)NC2=C(C=C(C=C2)N)Cl

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCC(=O)NC2=C(C=C(C=C2)N)Cl

InChI

InChI=1S/C15H22ClN3O/c1-11-4-2-3-8-19(11)9-7-15(20)18-14-6-5-12(17)10-13(14)16/h5-6,10-11H,2-4,7-9,17H2,1H3,(H,18,20)/p+1/t11-/m0/s1