(2S)-3-(4-hydroxyphenyl)-2-(quinolin-3-ylmethoxycarbonylamino)propanoic acid

Systemtic Name: (2S)-3-(4-hydroxyphenyl)-2-(quinolin-3-ylmethoxycarbonylamino)propanoic acid Openeye Name: (2S)-3-(4-hydroxyphenyl)-2-(3-quinolylmethoxycarbonylamino)propanoic acid CAS Name: (2S)-3-(4-hydroxyphenyl)-2-[[oxo(3-quinolinylmethoxy)methyl]amino]propanoic acid IUPAC Name: (2S)-3-(4-hydroxyphenyl)-2-(quinolin-3-ylmethoxycarbonylamino)propanoic acid Traditional Name: (2S)-3-(4-hydroxyphenyl)-2-(3-quinolylmethoxycarbonylamino)propionic acid Formula: C20H18N2O5 MolecularWeight: 366.36732

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C=N2)COC(=O)NC(CC3=CC=C(C=C3)O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C=N2)COC(=O)N[C@@H](CC3=CC=C(C=C3)O)C(=O)O

InChI

InChI=1S/C20H18N2O5/c23-16-7-5-13(6-8-16)10-18(19(24)25)22-20(26)27-12-14-9-15-3-1-2-4-17(15)21-11-14/h1-9,11,18,23H,10,12H2,(H,22,26)(H,24,25)/t18-/m0/s1