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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CCC(=O)NC2=CC(=C(C=C2)Cl)N

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CCC(=O)NC2=CC(=C(C=C2)Cl)N

InChI

InChI=1S/C15H22ClN3O/c1-11-3-2-7-19(10-11)8-6-15(20)18-12-4-5-13(16)14(17)9-12/h4-5,9,11H,2-3,6-8,10,17H2,1H3,(H,18,20)/p+1/t11-/m0/s1