[2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl] 2-[(5S,7S)-3-bromanyl-1-adamantyl]ethanoate

Systemtic Name: [2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl] 2-[(5S,7S)-3-bromanyl-1-adamantyl]ethanoate Openeye Name: [2-(tert-butylcarbamoylamino)-2-oxo-ethyl] 2-[(5S,7S)-3-bromo-1-adamantyl]acetate CAS Name: 2-[(5S,7S)-3-bromo-1-adamantyl]acetic acid [2-[[(tert-butylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(tert-butylcarbamoylamino)-2-oxoethyl] 2-[(5S,7S)-3-bromo-1-adamantyl]acetate Traditional Name: 2-[(5S,7S)-3-bromo-1-adamantyl]acetic acid [2-(tert-butylcarbamoylamino)-2-keto-ethyl] ester Formula: C19H29BrN2O4 MolecularWeight: 429.34856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NC(=O)COC(=O)CC12CC3CC(C1)CC(C3)(C2)Br

Isomeric SMILES

CC(C)(C)NC(=O)NC(=O)COC(=O)CC12C[C@@H]3C[C@@H](C1)CC(C3)(C2)Br

InChI

InChI=1S/C19H29BrN2O4/c1-17(2,3)22-16(25)21-14(23)10-26-15(24)9-18-5-12-4-13(6-18)8-19(20,7-12)11-18/h12-13H,4-11H2,1-3H3,(H2,21,22,23,25)/t12-,13-,18?,19?/m0/s1