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

Systemtic Name: (2S)-N-(2-azanyl-4-methoxy-phenyl)-2-pyrrolidin-1-ium-1-yl-propanamide Openeye Name: (2S)-N-(2-amino-4-methoxy-phenyl)-2-pyrrolidin-1-ium-1-yl-propanamide CAS Name: (2S)-N-(2-amino-4-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)propanamide IUPAC Name: (2S)-N-(2-amino-4-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylpropanamide Traditional Name: (2S)-N-(2-amino-4-methoxy-phenyl)-2-pyrrolidin-1-ium-1-yl-propionamide Formula: C14H22N3O2+ MolecularWeight: 264.34338

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)OC)N)[NH+]2CCCC2

Isomeric SMILES

C[C@@H](C(=O)NC1=C(C=C(C=C1)OC)N)[NH+]2CCCC2

InChI

InChI=1S/C14H21N3O2/c1-10(17-7-3-4-8-17)14(18)16-13-6-5-11(19-2)9-12(13)15/h5-6,9-10H,3-4,7-8,15H2,1-2H3,(H,16,18)/p+1/t10-/m0/s1