(2S)-3-(4-hydroxyphenyl)-2-(octanoylamino)propanoic acid

Systemtic Name: (2S)-3-(4-hydroxyphenyl)-2-(octanoylamino)propanoic acid Openeye Name: (2S)-3-(4-hydroxyphenyl)-2-(octanoylamino)propanoic acid CAS Name: (2S)-3-(4-hydroxyphenyl)-2-(1-oxooctylamino)propanoic acid IUPAC Name: (2S)-3-(4-hydroxyphenyl)-2-(octanoylamino)propanoic acid Traditional Name: (2S)-2-(caprylylamino)-3-(4-hydroxyphenyl)propionic acid Formula: C17H25NO4 MolecularWeight: 307.3847

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25NO4/c1-2-3-4-5-6-7-16(20)18-15(17(21)22)12-13-8-10-14(19)11-9-13/h8-11,15,19H,2-7,12H2,1H3,(H,18,20)(H,21,22)/t15-/m0/s1