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

Systemtic Name: (2R)-3-(4-hydroxyphenyl)-2-(3-oxidanylideneheptanoylamino)propanoic acid Openeye Name: (2R)-3-(4-hydroxyphenyl)-2-(3-oxoheptanoylamino)propanoic acid CAS Name: (2R)-2-(1,3-dioxoheptylamino)-3-(4-hydroxyphenyl)propanoic acid IUPAC Name: (2R)-3-(4-hydroxyphenyl)-2-(3-oxoheptanoylamino)propanoic acid Traditional Name: (2R)-3-(4-hydroxyphenyl)-2-(3-ketoheptanoylamino)propionic acid Formula: C16H21NO5 MolecularWeight: 307.34164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO5/c1-2-3-4-13(19)10-15(20)17-14(16(21)22)9-11-5-7-12(18)8-6-11/h5-8,14,18H,2-4,9-10H2,1H3,(H,17,20)(H,21,22)/t14-/m1/s1