(2S)-2-[(2-hydroxyphenyl)methylazaniumyl]-3-phenyl-propanoate

Systemtic Name: (2S)-2-[(2-hydroxyphenyl)methylazaniumyl]-3-phenyl-propanoate Openeye Name: (2S)-2-[(2-hydroxyphenyl)methylammonio]-3-phenyl-propanoate CAS Name: (2S)-2-[(2-hydroxyphenyl)methylammonio]-3-phenylpropanoate IUPAC Name: (2S)-2-[(2-hydroxyphenyl)methylazaniumyl]-3-phenylpropanoate Traditional Name: (2S)-3-phenyl-2-(salicylammonio)propionate Formula: C16H17NO3 MolecularWeight: 271.31108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)[O-])[NH2+]CC2=CC=CC=C2O

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)[O-])[NH2+]CC2=CC=CC=C2O

InChI

InChI=1S/C16H17NO3/c18-15-9-5-4-8-13(15)11-17-14(16(19)20)10-12-6-2-1-3-7-12/h1-9,14,17-18H,10-11H2,(H,19,20)/t14-/m0/s1