Molecule ID: 77033

IUPAC Name: ethyl (2S)-2-benzamido-3-(4-hydroxyphenyl)propanoate

Description: The molecule is an L-tyrosine derivative that is the ethyl ester of N-benzoyltyrosine. It has a role as a chromogenic compound. It is a L-tyrosine derivative, an ethyl ester, a member of phenols and a member of benzamides.

SMILES: CCOC(=O)[C@H](Cc1ccc(O)cc1)N=C(O)c1ccccc1

SELFIES: [C][C][O][C][=Branch1][C][=O][C@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][N][=C][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1]

InChI: InChI=1S/C18H19NO4/c1-2-23-18(22)16(12-13-8-10-15(20)11-9-13)19-17(21)14-6-4-3-5-7-14/h3-11,16,20H,2,12H2,1H3,(H,19,21)/t16-/m0/s1

Molecular Properties:
- Polar Surface Area: 75.6 Ų
- LogP: 2.4