dimethyl 2-[(2-chloranyl-5-nitro-phenyl)methyl]-2-methyl-propanedioate

Systemtic Name: dimethyl 2-[(2-chloranyl-5-nitro-phenyl)methyl]-2-methyl-propanedioate Openeye Name: dimethyl 2-[(2-chloro-5-nitro-phenyl)methyl]-2-methyl-propanedioate CAS Name: 2-[(2-chloro-5-nitrophenyl)methyl]-2-methylpropanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(2-chloro-5-nitrophenyl)methyl]-2-methylpropanedioate Traditional Name: 2-(2-chloro-5-nitro-benzyl)-2-methyl-malonic acid dimethyl ester Formula: C13H14ClNO6 MolecularWeight: 315.70636

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)(C(=O)OC)C(=O)OC

Isomeric SMILES

CC(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)(C(=O)OC)C(=O)OC

InChI

InChI=1S/C13H14ClNO6/c1-13(11(16)20-2,12(17)21-3)7-8-6-9(15(18)19)4-5-10(8)14/h4-6H,7H2,1-3H3