(3R)-1-[2-(2-hexoxy-4-methoxy-phenyl)ethyl]-5-oxidanylidene-pyrrolidine-3-carboxylic acid

Systemtic Name: (3R)-1-[2-(2-hexoxy-4-methoxy-phenyl)ethyl]-5-oxidanylidene-pyrrolidine-3-carboxylic acid Openeye Name: (3R)-1-[2-(2-hexoxy-4-methoxy-phenyl)ethyl]-5-oxo-pyrrolidine-3-carboxylic acid CAS Name: (3R)-1-[2-(2-hexoxy-4-methoxyphenyl)ethyl]-5-oxo-3-pyrrolidinecarboxylic acid IUPAC Name: (3R)-1-[2-(2-hexoxy-4-methoxyphenyl)ethyl]-5-oxopyrrolidine-3-carboxylic acid Traditional Name: (3R)-1-[2-(2-hexoxy-4-methoxy-phenyl)ethyl]-5-keto-pyrrolidine-3-carboxylic acid Formula: C20H29NO5 MolecularWeight: 363.44796

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=CC(=C1)OC)CCN2CC(CC2=O)C(=O)O

Isomeric SMILES

CCCCCCOC1=C(C=CC(=C1)OC)CCN2C[C@@H](CC2=O)C(=O)O

InChI

InChI=1S/C20H29NO5/c1-3-4-5-6-11-26-18-13-17(25-2)8-7-15(18)9-10-21-14-16(20(23)24)12-19(21)22/h7-8,13,16H,3-6,9-12,14H2,1-2H3,(H,23,24)/t16-/m1/s1