methyl 4-(4-chloranyl-6-nitro-thieno[2,3-d]pyrimidin-2-yl)benzoate

Systemtic Name: methyl 4-(4-chloranyl-6-nitro-thieno[2,3-d]pyrimidin-2-yl)benzoate Openeye Name: methyl 4-(4-chloro-6-nitro-thieno[2,3-d]pyrimidin-2-yl)benzoate CAS Name: 4-(4-chloro-6-nitro-2-thieno[2,3-d]pyrimidinyl)benzoic acid methyl ester IUPAC Name: methyl 4-(4-chloro-6-nitrothieno[2,3-d]pyrimidin-2-yl)benzoate Traditional Name: 4-(4-chloro-6-nitro-thieno[2,3-d]pyrimidin-2-yl)benzoic acid methyl ester Formula: C14H8ClN3O4S MolecularWeight: 349.74902

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=NC3=C(C=C(S3)[N+](=O)[O-])C(=N2)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=NC3=C(C=C(S3)[N+](=O)[O-])C(=N2)Cl

InChI

InChI=1S/C14H8ClN3O4S/c1-22-14(19)8-4-2-7(3-5-8)12-16-11(15)9-6-10(18(20)21)23-13(9)17-12/h2-6H,1H3