dimethyl 2-[(3-chlorophenyl)methyl]-2-(4-nitrophenyl)propanedioate

Systemtic Name: dimethyl 2-[(3-chlorophenyl)methyl]-2-(4-nitrophenyl)propanedioate Openeye Name: dimethyl 2-[(3-chlorophenyl)methyl]-2-(4-nitrophenyl)propanedioate CAS Name: 2-[(3-chlorophenyl)methyl]-2-(4-nitrophenyl)propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(3-chlorophenyl)methyl]-2-(4-nitrophenyl)propanedioate Traditional Name: 2-(3-chlorobenzyl)-2-(4-nitrophenyl)malonic acid dimethyl ester Formula: C18H16ClNO6 MolecularWeight: 377.77574

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC(=CC=C1)Cl)(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

COC(=O)C(CC1=CC(=CC=C1)Cl)(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C18H16ClNO6/c1-25-16(21)18(17(22)26-2,11-12-4-3-5-14(19)10-12)13-6-8-15(9-7-13)20(23)24/h3-10H,11H2,1-2H3