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

Systemtic Name: (2R)-3-(4-hydroxyphenyl)-2-(3-oxidanylidenenonanoylamino)propanoic acid Openeye Name: (2R)-3-(4-hydroxyphenyl)-2-(3-oxononanoylamino)propanoic acid CAS Name: (2R)-2-(1,3-dioxononylamino)-3-(4-hydroxyphenyl)propanoic acid IUPAC Name: (2R)-3-(4-hydroxyphenyl)-2-(3-oxononanoylamino)propanoic acid Traditional Name: (2R)-3-(4-hydroxyphenyl)-2-(3-ketononanoylamino)propionic acid Formula: C18H25NO5 MolecularWeight: 335.3948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25NO5/c1-2-3-4-5-6-15(21)12-17(22)19-16(18(23)24)11-13-7-9-14(20)10-8-13/h7-10,16,20H,2-6,11-12H2,1H3,(H,19,22)(H,23,24)/t16-/m1/s1