ethyl 4-[[(2R)-1-chloranyl-3-oxidanyl-propan-2-yl]amino]benzoate

Systemtic Name: ethyl 4-[[(2R)-1-chloranyl-3-oxidanyl-propan-2-yl]amino]benzoate Openeye Name: ethyl 4-[[(1R)-1-(chloromethyl)-2-hydroxy-ethyl]amino]benzoate CAS Name: 4-[[(2R)-1-chloro-3-hydroxypropan-2-yl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(2R)-1-chloro-3-hydroxypropan-2-yl]amino]benzoate Traditional Name: 4-[[(1R)-1-(chloromethyl)-2-hydroxy-ethyl]amino]benzoic acid ethyl ester Formula: C12H16ClNO3 MolecularWeight: 257.71334

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(CO)CCl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N[C@H](CO)CCl

InChI

InChI=1S/C12H16ClNO3/c1-2-17-12(16)9-3-5-10(6-4-9)14-11(7-13)8-15/h3-6,11,14-15H,2,7-8H2,1H3/t11-/m0/s1