(2S)-2-(2-chloranylethanoylamino)-2-deuterio-3-(4-hydroxyphenyl)propanoic acid

Systemtic Name: (2S)-2-(2-chloranylethanoylamino)-2-deuterio-3-(4-hydroxyphenyl)propanoic acid Openeye Name: (2S)-2-[(2-chloroacetyl)amino]-2-deuterio-3-(4-hydroxyphenyl)propanoic acid CAS Name: (2S)-2-[(2-chloro-1-oxoethyl)amino]-2-deuterio-3-(4-hydroxyphenyl)propanoic acid IUPAC Name: (2S)-2-[(2-chloroacetyl)amino]-2-deuterio-3-(4-hydroxyphenyl)propanoic acid Traditional Name: (2S)-2-[(2-chloroacetyl)amino]-2-deuterio-3-(4-hydroxyphenyl)propionic acid Formula: C11H12ClNO4 MolecularWeight: 258.676442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)O)NC(=O)CCl)O

Isomeric SMILES

[2H][C@](CC1=CC=C(C=C1)O)(C(=O)O)NC(=O)CCl

InChI

InChI=1S/C11H12ClNO4/c12-6-10(15)13-9(11(16)17)5-7-1-3-8(14)4-2-7/h1-4,9,14H,5-6H2,(H,13,15)(H,16,17)/t9-/m0/s1/i9D