3-(4-phenylphenyl)-3-[2-[2-(pyridin-2-ylamino)propoxycarbonylamino]ethanoylamino]propanoic acid

Systemtic Name: 3-(4-phenylphenyl)-3-[2-[2-(pyridin-2-ylamino)propoxycarbonylamino]ethanoylamino]propanoic acid Openeye Name: 3-(4-phenylphenyl)-3-[[2-[2-(2-pyridylamino)propoxycarbonylamino]acetyl]amino]propanoic acid CAS Name: 3-[[1-oxo-2-[[oxo-[2-(2-pyridinylamino)propoxy]methyl]amino]ethyl]amino]-3-(4-phenylphenyl)propanoic acid IUPAC Name: 3-(4-phenylphenyl)-3-[[2-[2-(pyridin-2-ylamino)propoxycarbonylamino]acetyl]amino]propanoic acid Traditional Name: 3-(4-phenylphenyl)-3-[[2-[2-(2-pyridylamino)propoxycarbonylamino]acetyl]amino]propionic acid Formula: C26H28N4O5 MolecularWeight: 476.52432

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC(=O)NCC(=O)NC(CC(=O)O)C1=CC=C(C=C1)C2=CC=CC=C2)NC3=CC=CC=N3

Isomeric SMILES

CC(COC(=O)NCC(=O)NC(CC(=O)O)C1=CC=C(C=C1)C2=CC=CC=C2)NC3=CC=CC=N3

InChI

InChI=1S/C26H28N4O5/c1-18(29-23-9-5-6-14-27-23)17-35-26(34)28-16-24(31)30-22(15-25(32)33)21-12-10-20(11-13-21)19-7-3-2-4-8-19/h2-14,18,22H,15-17H2,1H3,(H,27,29)(H,28,34)(H,30,31)(H,32,33)