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

Systemtic Name: (3R)-1-[[3-methoxy-4-(2-morpholin-4-ium-4-ylethoxy)phenyl]methyl]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (3R)-1-[[3-methoxy-4-(2-morpholin-4-ium-4-ylethoxy)phenyl]methyl]-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3R)-1-[[3-methoxy-4-[2-(4-morpholin-4-iumyl)ethoxy]phenyl]methyl]-5-oxo-3-pyrrolidinecarboxylate IUPAC Name: (3R)-1-[[3-methoxy-4-(2-morpholin-4-ium-4-ylethoxy)phenyl]methyl]-5-oxopyrrolidine-3-carboxylate Traditional Name: (3R)-5-keto-1-[3-methoxy-4-(2-morpholin-4-ium-4-ylethoxy)benzyl]pyrrolidine-3-carboxylate Formula: C19H26N2O6 MolecularWeight: 378.41954

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN2CC(CC2=O)C(=O)[O-])OCC[NH+]3CCOCC3

Isomeric SMILES

COC1=C(C=CC(=C1)CN2C[C@@H](CC2=O)C(=O)[O-])OCC[NH+]3CCOCC3

InChI

InChI=1S/C19H26N2O6/c1-25-17-10-14(12-21-13-15(19(23)24)11-18(21)22)2-3-16(17)27-9-6-20-4-7-26-8-5-20/h2-3,10,15H,4-9,11-13H2,1H3,(H,23,24)/t15-/m1/s1