(2R)-2-(4-chloranyl-2-methyl-phenoxy)propanoic acid; N-ethylethanamine

Systemtic Name: (2R)-2-(4-chloranyl-2-methyl-phenoxy)propanoic acid; N-ethylethanamine Openeye Name: (2R)-2-(4-chloro-2-methyl-phenoxy)propanoic acid; N-ethylethanamine CAS Name: (2R)-2-(4-chloro-2-methylphenoxy)propanoic acid; N-ethylethanamine IUPAC Name: (2R)-2-(4-chloro-2-methylphenoxy)propanoic acid; N-ethylethanamine Traditional Name: (2R)-2-(4-chloro-2-methyl-phenoxy)propionic acid; diethylamine Formula: C14H22ClNO3 MolecularWeight: 287.78238

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC.CC1=C(C=CC(=C1)Cl)OC(C)C(=O)O

Isomeric SMILES

CCNCC.CC1=C(C=CC(=C1)Cl)O[C@H](C)C(=O)O

InChI

InChI=1S/C10H11ClO3.C4H11N/c1-6-5-8(11)3-4-9(6)14-7(2)10(12)13;1-3-5-4-2/h3-5,7H,1-2H3,(H,12,13);5H,3-4H2,1-2H3/t7-;/m1./s1