(7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 1-methylsulfonylpiperidine-4-carboxylate

Systemtic Name: (7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 1-methylsulfonylpiperidine-4-carboxylate Openeye Name: (7-bromo-2-oxo-chromen-4-yl)methyl 1-methylsulfonylpiperidine-4-carboxylate CAS Name: 1-methylsulfonyl-4-piperidinecarboxylic acid (7-bromo-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-bromo-2-oxochromen-4-yl)methyl 1-methylsulfonylpiperidine-4-carboxylate Traditional Name: 1-mesylisonipecotic acid (7-bromo-2-keto-chromen-4-yl)methyl ester Formula: C17H18BrNO6S MolecularWeight: 444.29692

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)Br

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)Br

InChI

InChI=1S/C17H18BrNO6S/c1-26(22,23)19-6-4-11(5-7-19)17(21)24-10-12-8-16(20)25-15-9-13(18)2-3-14(12)15/h2-3,8-9,11H,4-7,10H2,1H3