2-[4-[(2-chloranylethanoylamino)methyl]-2-methyl-phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[4-[(2-chloranylethanoylamino)methyl]-2-methyl-phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-[[(2-chloroacetyl)amino]methyl]-2-methyl-phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-[[(2-chloro-1-oxoethyl)amino]methyl]-2-methylphenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-[[(2-chloroacetyl)amino]methyl]-2-methylphenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-[[(2-chloroacetyl)amino]methyl]-2-methyl-phenoxy]-2-methyl-propionic acid Formula: C14H18ClNO4 MolecularWeight: 299.75002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CNC(=O)CCl)OC(C)(C)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)CNC(=O)CCl)OC(C)(C)C(=O)O

InChI

InChI=1S/C14H18ClNO4/c1-9-6-10(8-16-12(17)7-15)4-5-11(9)20-14(2,3)13(18)19/h4-6H,7-8H2,1-3H3,(H,16,17)(H,18,19)