azanyl (2S)-2-azanyl-3-phenyl-propanoate; (2S)-2-azanyl-3-(4-hydroxyphenyl)propanoic acid

Systemtic Name: azanyl (2S)-2-azanyl-3-phenyl-propanoate; (2S)-2-azanyl-3-(4-hydroxyphenyl)propanoic acid Openeye Name: amino (2S)-2-amino-3-phenyl-propanoate; (2S)-2-amino-3-(4-hydroxyphenyl)propanoic acid CAS Name: (2S)-2-amino-3-(4-hydroxyphenyl)propanoic acid; (2S)-2-amino-3-phenylpropanoic acid amino ester IUPAC Name: amino (2S)-2-amino-3-phenylpropanoate; (2S)-2-amino-3-(4-hydroxyphenyl)propanoic acid Traditional Name: (2S)-2-amino-3-(4-hydroxyphenyl)propionic acid; (2S)-2-amino-3-phenyl-propionic acid amino ester Formula: C18H23N3O5 MolecularWeight: 361.39232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)ON)N.C1=CC(=CC=C1CC(C(=O)O)N)O

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)ON)N.C1=CC(=CC=C1C[C@@H](C(=O)O)N)O

InChI

InChI=1S/C9H12N2O2.C9H11NO3/c10-8(9(12)13-11)6-7-4-2-1-3-5-7;10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-5,8H,6,10-11H2;1-4,8,11H,5,10H2,(H,12,13)/t2*8-/m00/s1