(2-bromanyl-4-methoxy-phenyl)methyl 8-oxidanylidene-6-sulfanylidene-7,9-diazaspiro[4.4]nonane-4-carboxylate

Systemtic Name: (2-bromanyl-4-methoxy-phenyl)methyl 8-oxidanylidene-6-sulfanylidene-7,9-diazaspiro[4.4]nonane-4-carboxylate Openeye Name: (2-bromo-4-methoxy-phenyl)methyl 8-oxo-6-thioxo-7,9-diazaspiro[4.4]nonane-4-carboxylate CAS Name: 8-oxo-6-sulfanylidene-7,9-diazaspiro[4.4]nonane-4-carboxylic acid (2-bromo-4-methoxyphenyl)methyl ester IUPAC Name: (2-bromo-4-methoxyphenyl)methyl 8-oxo-6-sulfanylidene-7,9-diazaspiro[4.4]nonane-4-carboxylate Traditional Name: 8-keto-6-thioxo-7,9-diazaspiro[4.4]nonane-4-carboxylic acid (2-bromo-4-methoxy-benzyl) ester Formula: C16H17BrN2O4S MolecularWeight: 413.28618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)COC(=O)C2CCCC23C(=S)NC(=O)N3)Br

Isomeric SMILES

COC1=CC(=C(C=C1)COC(=O)C2CCCC23C(=S)NC(=O)N3)Br

InChI

InChI=1S/C16H17BrN2O4S/c1-22-10-5-4-9(12(17)7-10)8-23-13(20)11-3-2-6-16(11)14(24)18-15(21)19-16/h4-5,7,11H,2-3,6,8H2,1H3,(H2,18,19,21,24)