O4-ethyl O6-methyl 5-(3-chlorophenyl)-2-methanoyl-7-methyl-1,3-benzothiazole-4,6-dicarboxylate

Systemtic Name: O4-ethyl O6-methyl 5-(3-chlorophenyl)-2-methanoyl-7-methyl-1,3-benzothiazole-4,6-dicarboxylate Openeye Name: O4-ethyl O6-methyl 5-(3-chlorophenyl)-2-formyl-7-methyl-1,3-benzothiazole-4,6-dicarboxylate CAS Name: 5-(3-chlorophenyl)-2-formyl-7-methyl-1,3-benzothiazole-4,6-dicarboxylic acid O4-ethyl ester O6-methyl ester IUPAC Name: 4-O-ethyl 6-O-methyl 5-(3-chlorophenyl)-2-formyl-7-methyl-1,3-benzothiazole-4,6-dicarboxylate Traditional Name: 5-(3-chlorophenyl)-2-formyl-7-methyl-1,3-benzothiazole-4,6-dicarboxylic acid O4-ethyl ester O6-methyl ester Formula: C20H16ClNO5S MolecularWeight: 417.86274

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C(=C(C(=C1C3=CC(=CC=C3)Cl)C(=O)OC)C)SC(=N2)C=O

Isomeric SMILES

CCOC(=O)C1=C2C(=C(C(=C1C3=CC(=CC=C3)Cl)C(=O)OC)C)SC(=N2)C=O

InChI

InChI=1S/C20H16ClNO5S/c1-4-27-20(25)16-15(11-6-5-7-12(21)8-11)14(19(24)26-3)10(2)18-17(16)22-13(9-23)28-18/h5-9H,4H2,1-3H3