dimethyl 1-chloranyl-9H-pyrrolo[2,1-b][1,3]benzothiazine-2,3-dicarboxylate

Systemtic Name: dimethyl 1-chloranyl-9H-pyrrolo[2,1-b][1,3]benzothiazine-2,3-dicarboxylate Openeye Name: dimethyl 1-chloro-9H-pyrrolo[2,1-b][1,3]benzothiazine-2,3-dicarboxylate CAS Name: 1-chloro-9H-pyrrolo[2,1-b][1,3]benzothiazine-2,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-chloro-9H-pyrrolo[2,1-b][1,3]benzothiazine-2,3-dicarboxylate Traditional Name: 1-chloro-9H-pyrrolo[2,1-b][1,3]benzothiazine-2,3-dicarboxylic acid dimethyl ester Formula: C15H12ClNO4S MolecularWeight: 337.77808

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2N(CC3=CC=CC=C3S2)C(=C1C(=O)OC)Cl

Isomeric SMILES

COC(=O)C1=C2N(CC3=CC=CC=C3S2)C(=C1C(=O)OC)Cl

InChI

InChI=1S/C15H12ClNO4S/c1-20-14(18)10-11(15(19)21-2)13-17(12(10)16)7-8-5-3-4-6-9(8)22-13/h3-6H,7H2,1-2H3