2,4-bis(1,3-benzodioxol-5-yl)-1-[2-oxidanylidene-2-(propylamino)ethyl]pyrrolidine-3-carboxylic acid

Systemtic Name: 2,4-bis(1,3-benzodioxol-5-yl)-1-[2-oxidanylidene-2-(propylamino)ethyl]pyrrolidine-3-carboxylic acid Openeye Name: 2,4-bis(1,3-benzodioxol-5-yl)-1-[2-oxo-2-(propylamino)ethyl]pyrrolidine-3-carboxylic acid CAS Name: 2,4-bis(1,3-benzodioxol-5-yl)-1-[2-oxo-2-(propylamino)ethyl]-3-pyrrolidinecarboxylic acid IUPAC Name: 2,4-bis(1,3-benzodioxol-5-yl)-1-[2-oxo-2-(propylamino)ethyl]pyrrolidine-3-carboxylic acid Traditional Name: 2,4-bis(1,3-benzodioxol-5-yl)-1-[2-keto-2-(propylamino)ethyl]pyrrolidine-3-carboxylic acid Formula: C24H26N2O7 MolecularWeight: 454.47244

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN1CC(C(C1C2=CC3=C(C=C2)OCO3)C(=O)O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCNC(=O)CN1CC(C(C1C2=CC3=C(C=C2)OCO3)C(=O)O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H26N2O7/c1-2-7-25-21(27)11-26-10-16(14-3-5-17-19(8-14)32-12-30-17)22(24(28)29)23(26)15-4-6-18-20(9-15)33-13-31-18/h3-6,8-9,16,22-23H,2,7,10-13H2,1H3,(H,25,27)(H,28,29)