(2S,3S,4S)-4-(1,3-benzodioxol-5-yl)-1-(3-ethoxy-2-oxidanylidene-propyl)-2-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid

Systemtic Name: (2S,3S,4S)-4-(1,3-benzodioxol-5-yl)-1-(3-ethoxy-2-oxidanylidene-propyl)-2-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid Openeye Name: (2S,3S,4S)-4-(1,3-benzodioxol-5-yl)-1-(3-ethoxy-2-oxo-propyl)-2-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid CAS Name: (2S,3S,4S)-4-(1,3-benzodioxol-5-yl)-1-(3-ethoxy-2-oxopropyl)-2-(4-methoxyphenyl)-3-pyrrolidinecarboxylic acid IUPAC Name: (2S,3S,4S)-4-(1,3-benzodioxol-5-yl)-1-(3-ethoxy-2-oxopropyl)-2-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid Traditional Name: (2S,3S,4S)-4-(1,3-benzodioxol-5-yl)-1-(3-ethoxy-2-keto-propyl)-2-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid Formula: C24H27NO7 MolecularWeight: 441.47368

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC(=O)CN1CC(C(C1C2=CC=C(C=C2)OC)C(=O)O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOCC(=O)CN1C[C@@H]([C@@H]([C@H]1C2=CC=C(C=C2)OC)C(=O)O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H27NO7/c1-3-30-13-17(26)11-25-12-19(16-6-9-20-21(10-16)32-14-31-20)22(24(27)28)23(25)15-4-7-18(29-2)8-5-15/h4-10,19,22-23H,3,11-14H2,1-2H3,(H,27,28)/t19-,22+,23-/m1/s1