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

Systemtic Name: N-(2-azanyl-4-chloranyl-phenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanamide Openeye Name: N-(2-amino-4-chloro-phenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide CAS Name: N-(2-amino-4-chlorophenyl)-2-[(3S)-3-methyl-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(2-amino-4-chlorophenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Traditional Name: N-(2-amino-4-chloro-phenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Formula: C14H21ClN3O+ MolecularWeight: 282.78904

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20ClN3O/c1-10-3-2-6-18(8-10)9-14(19)17-13-5-4-11(15)7-12(13)16/h4-5,7,10H,2-3,6,8-9,16H2,1H3,(H,17,19)/p+1/t10-/m0/s1