ethyl 2-azanyl-3-oxidanyl-3-phenyl-propanoate; 4-methylbenzenesulfonic acid

Systemtic Name: ethyl 2-azanyl-3-oxidanyl-3-phenyl-propanoate; 4-methylbenzenesulfonic acid Openeye Name: ethyl 2-amino-3-hydroxy-3-phenyl-propanoate; 4-methylbenzenesulfonic acid CAS Name: 2-amino-3-hydroxy-3-phenylpropanoic acid ethyl ester; 4-methylbenzenesulfonic acid IUPAC Name: ethyl 2-amino-3-hydroxy-3-phenylpropanoate; 4-methylbenzenesulfonic acid Traditional Name: 2-amino-3-hydroxy-3-phenyl-propionic acid ethyl ester; tosylic acid Formula: C18H23NO6S MolecularWeight: 381.44332

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC=CC=C1)O)N.CC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CCOC(=O)C(C(C1=CC=CC=C1)O)N.CC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C11H15NO3.C7H8O3S/c1-2-15-11(14)9(12)10(13)8-6-4-3-5-7-8;1-6-2-4-7(5-3-6)11(8,9)10/h3-7,9-10,13H,2,12H2,1H3;2-5H,1H3,(H,8,9,10)