(2R)-3-(4-hydroxyphenyl)-2-(3-oxidanylideneoctanoylamino)propanoic acid

Systemtic Name: (2R)-3-(4-hydroxyphenyl)-2-(3-oxidanylideneoctanoylamino)propanoic acid Openeye Name: (2R)-3-(4-hydroxyphenyl)-2-(3-oxooctanoylamino)propanoic acid CAS Name: (2R)-2-(1,3-dioxooctylamino)-3-(4-hydroxyphenyl)propanoic acid IUPAC Name: (2R)-3-(4-hydroxyphenyl)-2-(3-oxooctanoylamino)propanoic acid Traditional Name: (2R)-3-(4-hydroxyphenyl)-2-(3-ketooctanoylamino)propionic acid Formula: C17H23NO5 MolecularWeight: 321.36822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)CC(=O)NC(CC1=CC=C(C=C1)O)C(=O)O

Isomeric SMILES

CCCCCC(=O)CC(=O)N[C@H](CC1=CC=C(C=C1)O)C(=O)O

InChI

InChI=1S/C17H23NO5/c1-2-3-4-5-14(20)11-16(21)18-15(17(22)23)10-12-6-8-13(19)9-7-12/h6-9,15,19H,2-5,10-11H2,1H3,(H,18,21)(H,22,23)/t15-/m1/s1