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

Systemtic Name: (2S)-N-(4-azanyl-2-methoxy-phenyl)-2-piperidin-1-ium-1-yl-propanamide Openeye Name: (2S)-N-(4-amino-2-methoxy-phenyl)-2-piperidin-1-ium-1-yl-propanamide CAS Name: (2S)-N-(4-amino-2-methoxyphenyl)-2-(1-piperidin-1-iumyl)propanamide IUPAC Name: (2S)-N-(4-amino-2-methoxyphenyl)-2-piperidin-1-ium-1-ylpropanamide Traditional Name: (2S)-N-(4-amino-2-methoxy-phenyl)-2-piperidin-1-ium-1-yl-propionamide Formula: C15H24N3O2+ MolecularWeight: 278.36996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)N)OC)[NH+]2CCCCC2

Isomeric SMILES

C[C@@H](C(=O)NC1=C(C=C(C=C1)N)OC)[NH+]2CCCCC2

InChI

InChI=1S/C15H23N3O2/c1-11(18-8-4-3-5-9-18)15(19)17-13-7-6-12(16)10-14(13)20-2/h6-7,10-11H,3-5,8-9,16H2,1-2H3,(H,17,19)/p+1/t11-/m0/s1