diethyl 2-(4-azanyl-3-chloranyl-phenyl)-2-methyl-propanedioate

Systemtic Name: diethyl 2-(4-azanyl-3-chloranyl-phenyl)-2-methyl-propanedioate Openeye Name: diethyl 2-(4-amino-3-chloro-phenyl)-2-methyl-propanedioate CAS Name: 2-(4-amino-3-chlorophenyl)-2-methylpropanedioic acid diethyl ester IUPAC Name: diethyl 2-(4-amino-3-chlorophenyl)-2-methylpropanedioate Traditional Name: 2-(4-amino-3-chloro-phenyl)-2-methyl-malonic acid diethyl ester Formula: C14H18ClNO4 MolecularWeight: 299.75002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C1=CC(=C(C=C1)N)Cl)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C)(C1=CC(=C(C=C1)N)Cl)C(=O)OCC

InChI

InChI=1S/C14H18ClNO4/c1-4-19-12(17)14(3,13(18)20-5-2)9-6-7-11(16)10(15)8-9/h6-8H,4-5,16H2,1-3H3