methyl 3-(1,3-benzodioxol-5-ylmethyl)-2-(4-fluorophenyl)imino-4-oxidanylidene-1,3-thiazine-6-carboxylate

Systemtic Name: methyl 3-(1,3-benzodioxol-5-ylmethyl)-2-(4-fluorophenyl)imino-4-oxidanylidene-1,3-thiazine-6-carboxylate Openeye Name: methyl 3-(1,3-benzodioxol-5-ylmethyl)-2-(4-fluorophenyl)imino-4-oxo-1,3-thiazine-6-carboxylate CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(4-fluorophenyl)imino-4-oxo-1,3-thiazine-6-carboxylic acid methyl ester IUPAC Name: methyl 3-(1,3-benzodioxol-5-ylmethyl)-2-(4-fluorophenyl)imino-4-oxo-1,3-thiazine-6-carboxylate Traditional Name: 2-(4-fluorophenyl)imino-4-keto-3-piperonyl-1,3-thiazine-6-carboxylic acid methyl ester Formula: C20H15FN2O5S MolecularWeight: 414.406903

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=O)N(C(=NC2=CC=C(C=C2)F)S1)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC(=O)C1=CC(=O)N(C(=NC2=CC=C(C=C2)F)S1)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H15FN2O5S/c1-26-19(25)17-9-18(24)23(10-12-2-7-15-16(8-12)28-11-27-15)20(29-17)22-14-5-3-13(21)4-6-14/h2-9H,10-11H2,1H3