(2S,5S)-5-methoxycarbonyl-1-[(1S)-1-phenylethyl]pyrrolidin-1-ium-2-carboxylate

Systemtic Name: (2S,5S)-5-methoxycarbonyl-1-[(1S)-1-phenylethyl]pyrrolidin-1-ium-2-carboxylate Openeye Name: (2S,5S)-5-methoxycarbonyl-1-[(1S)-1-phenylethyl]pyrrolidin-1-ium-2-carboxylate CAS Name: (2S,5S)-5-methoxycarbonyl-1-[(1S)-1-phenylethyl]-2-pyrrolidin-1-iumcarboxylate IUPAC Name: (2S,5S)-5-methoxycarbonyl-1-[(1S)-1-phenylethyl]pyrrolidin-1-ium-2-carboxylate Traditional Name: (2S,5S)-5-carbomethoxy-1-[(1S)-1-phenylethyl]pyrrolidin-1-ium-2-carboxylate Formula: C15H19NO4 MolecularWeight: 277.31566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[NH+]2C(CCC2C(=O)OC)C(=O)[O-]

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)[NH+]2[C@@H](CC[C@H]2C(=O)OC)C(=O)[O-]

InChI

InChI=1S/C15H19NO4/c1-10(11-6-4-3-5-7-11)16-12(14(17)18)8-9-13(16)15(19)20-2/h3-7,10,12-13H,8-9H2,1-2H3,(H,17,18)/t10-,12-,13-/m0/s1