[2-(1-adamantyl)-2-oxidanylidene-ethyl] 2-[(3-bromophenyl)sulfonylamino]ethanoate

Systemtic Name: [2-(1-adamantyl)-2-oxidanylidene-ethyl] 2-[(3-bromophenyl)sulfonylamino]ethanoate Openeye Name: [2-(1-adamantyl)-2-oxo-ethyl] 2-[(3-bromophenyl)sulfonylamino]acetate CAS Name: 2-[(3-bromophenyl)sulfonylamino]acetic acid [2-(1-adamantyl)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantyl)-2-oxoethyl] 2-[(3-bromophenyl)sulfonylamino]acetate Traditional Name: 2-[(3-bromophenyl)sulfonylamino]acetic acid [2-(1-adamantyl)-2-keto-ethyl] ester Formula: C20H24BrNO5S MolecularWeight: 470.37726

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)COC(=O)CNS(=O)(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)COC(=O)CNS(=O)(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C20H24BrNO5S/c21-16-2-1-3-17(7-16)28(25,26)22-11-19(24)27-12-18(23)20-8-13-4-14(9-20)6-15(5-13)10-20/h1-3,7,13-15,22H,4-6,8-12H2