N-(3-aminophenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-aminophenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanamide Openeye Name: N-(3-aminophenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide CAS Name: N-(3-aminophenyl)-2-[(3S)-3-methyl-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(3-aminophenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Traditional Name: N-(3-aminophenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Formula: C14H22N3O+ MolecularWeight: 248.34398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O/c1-11-4-3-7-17(9-11)10-14(18)16-13-6-2-5-12(15)8-13/h2,5-6,8,11H,3-4,7,9-10,15H2,1H3,(H,16,18)/p+1/t11-/m0/s1