(2S)-1-[(3-azanyl-4-methoxy-phenyl)methyl]pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S)-1-[(3-azanyl-4-methoxy-phenyl)methyl]pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S)-1-[(3-amino-4-methoxy-phenyl)methyl]pyrrolidin-1-ium-2-carboxamide CAS Name: (2S)-1-[(3-amino-4-methoxyphenyl)methyl]-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S)-1-[(3-amino-4-methoxyphenyl)methyl]pyrrolidin-1-ium-2-carboxamide Traditional Name: (2S)-1-(3-amino-4-methoxy-benzyl)pyrrolidin-1-ium-2-carboxamide Formula: C13H20N3O2+ MolecularWeight: 250.3168

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH+]2CCCC2C(=O)N)N

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH+]2CCC[C@H]2C(=O)N)N

InChI

InChI=1S/C13H19N3O2/c1-18-12-5-4-9(7-10(12)14)8-16-6-2-3-11(16)13(15)17/h4-5,7,11H,2-3,6,8,14H2,1H3,(H2,15,17)/p+1/t11-/m0/s1