octyl 5-methyl-2-octoxy-4-oxidanylidene-thieno[2,3-d][1,3]oxazine-6-carboxylate

Systemtic Name: octyl 5-methyl-2-octoxy-4-oxidanylidene-thieno[2,3-d][1,3]oxazine-6-carboxylate Openeye Name: octyl 5-methyl-2-octoxy-4-oxo-thieno[2,3-d][1,3]oxazine-6-carboxylate CAS Name: 5-methyl-2-octoxy-4-oxo-6-thieno[2,3-d][1,3]oxazinecarboxylic acid octyl ester IUPAC Name: octyl 5-methyl-2-octoxy-4-oxothieno[2,3-d][1,3]oxazine-6-carboxylate Traditional Name: 4-keto-5-methyl-2-octoxy-thieno[2,3-d][1,3]oxazine-6-carboxylic acid octyl ester Formula: C24H37NO5S MolecularWeight: 451.61928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=NC2=C(C(=C(S2)C(=O)OCCCCCCCC)C)C(=O)O1

Isomeric SMILES

CCCCCCCCOC1=NC2=C(C(=C(S2)C(=O)OCCCCCCCC)C)C(=O)O1

InChI

InChI=1S/C24H37NO5S/c1-4-6-8-10-12-14-16-28-23(27)20-18(3)19-21(31-20)25-24(30-22(19)26)29-17-15-13-11-9-7-5-2/h4-17H2,1-3H3