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

Systemtic Name: N-(3-azanyl-2-methyl-phenyl)-3-[(2S)-2-methylpiperidin-1-ium-1-yl]propanamide Openeye Name: N-(3-amino-2-methyl-phenyl)-3-[(2S)-2-methylpiperidin-1-ium-1-yl]propanamide CAS Name: N-(3-amino-2-methylphenyl)-3-[(2S)-2-methyl-1-piperidin-1-iumyl]propanamide IUPAC Name: N-(3-amino-2-methylphenyl)-3-[(2S)-2-methylpiperidin-1-ium-1-yl]propanamide Traditional Name: N-(3-amino-2-methyl-phenyl)-3-[(2S)-2-methylpiperidin-1-ium-1-yl]propionamide Formula: C16H26N3O+ MolecularWeight: 276.39714

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCC(=O)NC2=CC=CC(=C2C)N

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCC(=O)NC2=CC=CC(=C2C)N

InChI

InChI=1S/C16H25N3O/c1-12-6-3-4-10-19(12)11-9-16(20)18-15-8-5-7-14(17)13(15)2/h5,7-8,12H,3-4,6,9-11,17H2,1-2H3,(H,18,20)/p+1/t12-/m0/s1