dimethyl 2-[(2-chloranyl-1,3-thiazol-5-yl)methyl]-2-(4-nitrophenyl)propanedioate

Systemtic Name: dimethyl 2-[(2-chloranyl-1,3-thiazol-5-yl)methyl]-2-(4-nitrophenyl)propanedioate Openeye Name: dimethyl 2-[(2-chlorothiazol-5-yl)methyl]-2-(4-nitrophenyl)propanedioate CAS Name: 2-[(2-chloro-5-thiazolyl)methyl]-2-(4-nitrophenyl)propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(2-chloro-1,3-thiazol-5-yl)methyl]-2-(4-nitrophenyl)propanedioate Traditional Name: 2-[(2-chlorothiazol-5-yl)methyl]-2-(4-nitrophenyl)malonic acid dimethyl ester Formula: C15H13ClN2O6S MolecularWeight: 384.79152

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CN=C(S1)Cl)(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

COC(=O)C(CC1=CN=C(S1)Cl)(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C15H13ClN2O6S/c1-23-12(19)15(13(20)24-2,7-11-8-17-14(16)25-11)9-3-5-10(6-4-9)18(21)22/h3-6,8H,7H2,1-2H3