(2R)-4-(4-ethoxyphenyl)-4-oxidanylidene-2-pyrrolidin-1-ium-1-yl-butanoate

Systemtic Name: (2R)-4-(4-ethoxyphenyl)-4-oxidanylidene-2-pyrrolidin-1-ium-1-yl-butanoate Openeye Name: (2R)-4-(4-ethoxyphenyl)-4-oxo-2-pyrrolidin-1-ium-1-yl-butanoate CAS Name: (2R)-4-(4-ethoxyphenyl)-4-oxo-2-(1-pyrrolidin-1-iumyl)butanoate IUPAC Name: (2R)-4-(4-ethoxyphenyl)-4-oxo-2-pyrrolidin-1-ium-1-ylbutanoate Traditional Name: (2R)-4-keto-4-p-phenetyl-2-pyrrolidin-1-ium-1-yl-butyrate Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)CC(C(=O)[O-])[NH+]2CCCC2

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)C[C@H](C(=O)[O-])[NH+]2CCCC2

InChI

InChI=1S/C16H21NO4/c1-2-21-13-7-5-12(6-8-13)15(18)11-14(16(19)20)17-9-3-4-10-17/h5-8,14H,2-4,9-11H2,1H3,(H,19,20)/t14-/m1/s1