3-[3-(3,3,3-triphenylpropanoylamino)propanoylamino]propanoic acid

Systemtic Name: 3-[3-(3,3,3-triphenylpropanoylamino)propanoylamino]propanoic acid Openeye Name: 3-[3-(3,3,3-triphenylpropanoylamino)propanoylamino]propanoic acid CAS Name: 3-[[1-oxo-3-[(1-oxo-3,3,3-triphenylpropyl)amino]propyl]amino]propanoic acid IUPAC Name: 3-[3-(3,3,3-triphenylpropanoylamino)propanoylamino]propanoic acid Traditional Name: 3-[3-(3,3,3-triphenylpropanoylamino)propanoylamino]propionic acid Formula: C27H28N2O4 MolecularWeight: 444.52222

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)NCCC(=O)NCCC(=O)O)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)NCCC(=O)NCCC(=O)O)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H28N2O4/c30-24(28-19-17-26(32)33)16-18-29-25(31)20-27(21-10-4-1-5-11-21,22-12-6-2-7-13-22)23-14-8-3-9-15-23/h1-15H,16-20H2,(H,28,30)(H,29,31)(H,32,33)