2-[[1-indolizin-3-yloxy-1-oxidanylidene-2-(phenylcarbonyl)butan-2-yl]amino]propanoic acid

Systemtic Name: 2-[[1-indolizin-3-yloxy-1-oxidanylidene-2-(phenylcarbonyl)butan-2-yl]amino]propanoic acid Openeye Name: 2-[(1-benzoyl-1-indolizin-3-yloxycarbonyl-propyl)amino]propanoic acid CAS Name: 2-[[2-benzoyl-1-(3-indolizinyloxy)-1-oxobutan-2-yl]amino]propanoic acid IUPAC Name: 2-[(2-benzoyl-1-indolizin-3-yloxy-1-oxobutan-2-yl)amino]propanoic acid Traditional Name: 2-[(1-benzoyl-1-indolizin-3-yloxycarbonyl-propyl)amino]propionic acid Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC=CC=C1)(C(=O)OC2=CC=C3N2C=CC=C3)NC(C)C(=O)O

Isomeric SMILES

CCC(C(=O)C1=CC=CC=C1)(C(=O)OC2=CC=C3N2C=CC=C3)NC(C)C(=O)O

InChI

InChI=1S/C22H22N2O5/c1-3-22(23-15(2)20(26)27,19(25)16-9-5-4-6-10-16)21(28)29-18-13-12-17-11-7-8-14-24(17)18/h4-15,23H,3H2,1-2H3,(H,26,27)