(2S)-2-[(E)-3-phenylprop-2-enyl]pyrrolidin-1-ium-2-carboxylate

Systemtic Name: (2S)-2-[(E)-3-phenylprop-2-enyl]pyrrolidin-1-ium-2-carboxylate Openeye Name: (2S)-2-[(E)-cinnamyl]pyrrolidin-1-ium-2-carboxylate CAS Name: (2S)-2-[(E)-3-phenylprop-2-enyl]-2-pyrrolidin-1-iumcarboxylate IUPAC Name: (2S)-2-[(E)-3-phenylprop-2-enyl]pyrrolidin-1-ium-2-carboxylate Traditional Name: (2S)-2-[(E)-cinnamyl]pyrrolidin-1-ium-2-carboxylate Formula: C14H17NO2 MolecularWeight: 231.29028

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH2+]C1)(CC=CC2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

C1C[C@]([NH2+]C1)(C/C=C/C2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C14H17NO2/c16-13(17)14(10-5-11-15-14)9-4-8-12-6-2-1-3-7-12/h1-4,6-8,15H,5,9-11H2,(H,16,17)/b8-4+/t14-/m1/s1