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

Systemtic Name: (2R)-4-(4-chlorophenyl)-4-oxidanylidene-2-pyrrolidin-1-ium-1-yl-butanoate Openeye Name: (2R)-4-(4-chlorophenyl)-4-oxo-2-pyrrolidin-1-ium-1-yl-butanoate CAS Name: (2R)-4-(4-chlorophenyl)-4-oxo-2-(1-pyrrolidin-1-iumyl)butanoate IUPAC Name: (2R)-4-(4-chlorophenyl)-4-oxo-2-pyrrolidin-1-ium-1-ylbutanoate Traditional Name: (2R)-4-(4-chlorophenyl)-4-keto-2-pyrrolidin-1-ium-1-yl-butyrate Formula: C14H16ClNO3 MolecularWeight: 281.73474

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CC(=O)C2=CC=C(C=C2)Cl)C(=O)[O-]

Isomeric SMILES

C1CC[NH+](C1)[C@H](CC(=O)C2=CC=C(C=C2)Cl)C(=O)[O-]

InChI

InChI=1S/C14H16ClNO3/c15-11-5-3-10(4-6-11)13(17)9-12(14(18)19)16-7-1-2-8-16/h3-6,12H,1-2,7-9H2,(H,18,19)/t12-/m1/s1