(3R)-1-[(3-hexoxy-4-methoxy-phenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxylic acid

Systemtic Name: (3R)-1-[(3-hexoxy-4-methoxy-phenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxylic acid Openeye Name: (3R)-1-[(3-hexoxy-4-methoxy-phenyl)methyl]-5-oxo-pyrrolidine-3-carboxylic acid CAS Name: (3R)-1-[(3-hexoxy-4-methoxyphenyl)methyl]-5-oxo-3-pyrrolidinecarboxylic acid IUPAC Name: (3R)-1-[(3-hexoxy-4-methoxyphenyl)methyl]-5-oxopyrrolidine-3-carboxylic acid Traditional Name: (3R)-1-(3-hexoxy-4-methoxy-benzyl)-5-keto-pyrrolidine-3-carboxylic acid Formula: C19H27NO5 MolecularWeight: 349.42138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=CC(=C1)CN2CC(CC2=O)C(=O)O)OC

Isomeric SMILES

CCCCCCOC1=C(C=CC(=C1)CN2C[C@@H](CC2=O)C(=O)O)OC

InChI

InChI=1S/C19H27NO5/c1-3-4-5-6-9-25-17-10-14(7-8-16(17)24-2)12-20-13-15(19(22)23)11-18(20)21/h7-8,10,15H,3-6,9,11-13H2,1-2H3,(H,22,23)/t15-/m1/s1