4-[2-[[1-(1,3-benzodioxol-5-yl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]propanoylamino]butanoic acid

Systemtic Name: 4-[2-[[1-(1,3-benzodioxol-5-yl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]propanoylamino]butanoic acid Openeye Name: 4-[2-[[1-(1,3-benzodioxol-5-yl)-5-oxo-pyrrolidine-3-carbonyl]amino]propanoylamino]butanoic acid CAS Name: 4-[[2-[[[1-(1,3-benzodioxol-5-yl)-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]-1-oxopropyl]amino]butanoic acid IUPAC Name: 4-[2-[[1-(1,3-benzodioxol-5-yl)-5-oxopyrrolidine-3-carbonyl]amino]propanoylamino]butanoic acid Traditional Name: 4-[2-[[1-(1,3-benzodioxol-5-yl)-5-keto-pyrrolidine-3-carbonyl]amino]propanoylamino]butyric acid Formula: C19H23N3O7 MolecularWeight: 405.40182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCCC(=O)O)NC(=O)C1CC(=O)N(C1)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C(=O)NCCCC(=O)O)NC(=O)C1CC(=O)N(C1)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H23N3O7/c1-11(18(26)20-6-2-3-17(24)25)21-19(27)12-7-16(23)22(9-12)13-4-5-14-15(8-13)29-10-28-14/h4-5,8,11-12H,2-3,6-7,9-10H2,1H3,(H,20,26)(H,21,27)(H,24,25)