(3R)-1-[[5-chloranyl-2-(2-morpholin-4-ium-4-ylethoxy)phenyl]methyl]-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (3R)-1-[[5-chloranyl-2-(2-morpholin-4-ium-4-ylethoxy)phenyl]methyl]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (3R)-1-[[5-chloro-2-(2-morpholin-4-ium-4-ylethoxy)phenyl]methyl]-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3R)-1-[[5-chloro-2-[2-(4-morpholin-4-iumyl)ethoxy]phenyl]methyl]-5-oxo-3-pyrrolidinecarboxylate IUPAC Name: (3R)-1-[[5-chloro-2-(2-morpholin-4-ium-4-ylethoxy)phenyl]methyl]-5-oxopyrrolidine-3-carboxylate Traditional Name: (3R)-1-[5-chloro-2-(2-morpholin-4-ium-4-ylethoxy)benzyl]-5-keto-pyrrolidine-3-carboxylate Formula: C18H23ClN2O5 MolecularWeight: 382.83862

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCOC2=C(C=C(C=C2)Cl)CN3CC(CC3=O)C(=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CCOC2=C(C=C(C=C2)Cl)CN3C[C@@H](CC3=O)C(=O)[O-]

InChI

InChI=1S/C18H23ClN2O5/c19-15-1-2-16(26-8-5-20-3-6-25-7-4-20)13(9-15)11-21-12-14(18(23)24)10-17(21)22/h1-2,9,14H,3-8,10-12H2,(H,23,24)/t14-/m1/s1