3-[2-[[2-(phenoxycarbamoylamino)phenyl]carbonylamino]ethanoylamino]-3-pyridin-3-yl-propanoic acid

Systemtic Name: 3-[2-[[2-(phenoxycarbamoylamino)phenyl]carbonylamino]ethanoylamino]-3-pyridin-3-yl-propanoic acid Openeye Name: 3-[[2-[[2-(phenoxycarbamoylamino)benzoyl]amino]acetyl]amino]-3-(3-pyridyl)propanoic acid CAS Name: 3-[[1-oxo-2-[[oxo-[2-[[oxo-(phenoxyamino)methyl]amino]phenyl]methyl]amino]ethyl]amino]-3-(3-pyridinyl)propanoic acid IUPAC Name: 3-[[2-[[2-(phenoxycarbamoylamino)benzoyl]amino]acetyl]amino]-3-pyridin-3-ylpropanoic acid Traditional Name: 3-[[2-[[2-(phenoxycarbamoylamino)benzoyl]amino]acetyl]amino]-3-(3-pyridyl)propionic acid Formula: C24H23N5O6 MolecularWeight: 477.46932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)ONC(=O)NC2=CC=CC=C2C(=O)NCC(=O)NC(CC(=O)O)C3=CN=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)ONC(=O)NC2=CC=CC=C2C(=O)NCC(=O)NC(CC(=O)O)C3=CN=CC=C3

InChI

InChI=1S/C24H23N5O6/c30-21(27-20(13-22(31)32)16-7-6-12-25-14-16)15-26-23(33)18-10-4-5-11-19(18)28-24(34)29-35-17-8-2-1-3-9-17/h1-12,14,20H,13,15H2,(H,26,33)(H,27,30)(H,31,32)(H2,28,29,34)