2-[2,4-dimethylpentanoyl-[(furan-2-ylcarbonylamino)methyl-oxidanyl-phosphoryl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[2,4-dimethylpentanoyl-[(furan-2-ylcarbonylamino)methyl-oxidanyl-phosphoryl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[2,4-dimethylpentanoyl-[(furan-2-carbonylamino)methyl-hydroxy-phosphoryl]amino]-3-phenyl-propanoic acid CAS Name: 2-[(2,4-dimethyl-1-oxopentyl)-[[[2-furanyl(oxo)methyl]amino]methyl-hydroxyphosphoryl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[2,4-dimethylpentanoyl-[(furan-2-carbonylamino)methyl-hydroxyphosphoryl]amino]-3-phenylpropanoic acid Traditional Name: 2-[2,4-dimethylpentanoyl-[(2-furoylamino)methyl-hydroxy-phosphoryl]amino]-3-phenyl-propionic acid Formula: C22H29N2O7P MolecularWeight: 464.448621

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C)C(=O)N(C(CC1=CC=CC=C1)C(=O)O)P(=O)(CNC(=O)C2=CC=CO2)O

Isomeric SMILES

CC(C)CC(C)C(=O)N(C(CC1=CC=CC=C1)C(=O)O)P(=O)(CNC(=O)C2=CC=CO2)O

InChI

InChI=1S/C22H29N2O7P/c1-15(2)12-16(3)21(26)24(18(22(27)28)13-17-8-5-4-6-9-17)32(29,30)14-23-20(25)19-10-7-11-31-19/h4-11,15-16,18H,12-14H2,1-3H3,(H,23,25)(H,27,28)(H,29,30)