(2S)-N-(5-azanyl-2-methoxy-phenyl)-2-(4-oxidanylpiperidin-1-ium-1-yl)propanamide

Systemtic Name: (2S)-N-(5-azanyl-2-methoxy-phenyl)-2-(4-oxidanylpiperidin-1-ium-1-yl)propanamide Openeye Name: (2S)-N-(5-amino-2-methoxy-phenyl)-2-(4-hydroxypiperidin-1-ium-1-yl)propanamide CAS Name: (2S)-N-(5-amino-2-methoxyphenyl)-2-(4-hydroxy-1-piperidin-1-iumyl)propanamide IUPAC Name: (2S)-N-(5-amino-2-methoxyphenyl)-2-(4-hydroxypiperidin-1-ium-1-yl)propanamide Traditional Name: (2S)-N-(5-amino-2-methoxy-phenyl)-2-(4-hydroxypiperidin-1-ium-1-yl)propionamide Formula: C15H24N3O3+ MolecularWeight: 294.36936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)N)OC)[NH+]2CCC(CC2)O

Isomeric SMILES

C[C@@H](C(=O)NC1=C(C=CC(=C1)N)OC)[NH+]2CCC(CC2)O

InChI

InChI=1S/C15H23N3O3/c1-10(18-7-5-12(19)6-8-18)15(20)17-13-9-11(16)3-4-14(13)21-2/h3-4,9-10,12,19H,5-8,16H2,1-2H3,(H,17,20)/p+1/t10-/m0/s1