3-[4-(3,3,3-triphenylpropanoylamino)butanoylamino]propanoic acid

Systemtic Name: 3-[4-(3,3,3-triphenylpropanoylamino)butanoylamino]propanoic acid Openeye Name: 3-[4-(3,3,3-triphenylpropanoylamino)butanoylamino]propanoic acid CAS Name: 3-[[1-oxo-4-[(1-oxo-3,3,3-triphenylpropyl)amino]butyl]amino]propanoic acid IUPAC Name: 3-[4-(3,3,3-triphenylpropanoylamino)butanoylamino]propanoic acid Traditional Name: 3-[4-(3,3,3-triphenylpropanoylamino)butanoylamino]propionic acid Formula: C28H30N2O4 MolecularWeight: 458.5488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H30N2O4/c31-25(30-20-18-27(33)34)17-10-19-29-26(32)21-28(22-11-4-1-5-12-22,23-13-6-2-7-14-23)24-15-8-3-9-16-24/h1-9,11-16H,10,17-21H2,(H,29,32)(H,30,31)(H,33,34)