4-[[2-acetamido-3-(4-phosphonooxyphenyl)propanoyl]amino]-4-(5-phenyl-1,3-thiazol-2-yl)butanoic acid

Systemtic Name: 4-[[2-acetamido-3-(4-phosphonooxyphenyl)propanoyl]amino]-4-(5-phenyl-1,3-thiazol-2-yl)butanoic acid Openeye Name: 4-[[2-acetamido-3-(4-phosphonooxyphenyl)propanoyl]amino]-4-(5-phenylthiazol-2-yl)butanoic acid CAS Name: 4-[[2-acetamido-1-oxo-3-(4-phosphonooxyphenyl)propyl]amino]-4-(5-phenyl-2-thiazolyl)butanoic acid IUPAC Name: 4-[[2-acetamido-3-(4-phosphonooxyphenyl)propanoyl]amino]-4-(5-phenyl-1,3-thiazol-2-yl)butanoic acid Traditional Name: 4-[[2-acetamido-3-(4-phosphonooxyphenyl)propanoyl]amino]-4-(5-phenylthiazol-2-yl)butyric acid Formula: C24H26N3O8PS MolecularWeight: 547.517301

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC=C(C=C1)OP(=O)(O)O)C(=O)NC(CCC(=O)O)C2=NC=C(S2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)NC(CC1=CC=C(C=C1)OP(=O)(O)O)C(=O)NC(CCC(=O)O)C2=NC=C(S2)C3=CC=CC=C3

InChI

InChI=1S/C24H26N3O8PS/c1-15(28)26-20(13-16-7-9-18(10-8-16)35-36(32,33)34)23(31)27-19(11-12-22(29)30)24-25-14-21(37-24)17-5-3-2-4-6-17/h2-10,14,19-20H,11-13H2,1H3,(H,26,28)(H,27,31)(H,29,30)(H2,32,33,34)