[3,5-bis[2,2,2-tris(bromanyl)ethanoylamino]-1-adamantyl] ethanoate

Systemtic Name: [3,5-bis[2,2,2-tris(bromanyl)ethanoylamino]-1-adamantyl] ethanoate Openeye Name: [3,5-bis[(2,2,2-tribromoacetyl)amino]-1-adamantyl] acetate CAS Name: acetic acid [3,5-bis[(2,2,2-tribromo-1-oxoethyl)amino]-1-adamantyl] ester IUPAC Name: [3,5-bis[(2,2,2-tribromoacetyl)amino]-1-adamantyl] acetate Traditional Name: acetic acid [3,5-bis[(2,2,2-tribromoacetyl)amino]-1-adamantyl] ester Formula: C16H18Br6N2O4 MolecularWeight: 781.74912

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC12CC3CC(C1)(CC(C3)(C2)NC(=O)C(Br)(Br)Br)NC(=O)C(Br)(Br)Br

Isomeric SMILES

CC(=O)OC12CC3CC(C1)(CC(C3)(C2)NC(=O)C(Br)(Br)Br)NC(=O)C(Br)(Br)Br

InChI

InChI=1S/C16H18Br6N2O4/c1-8(25)28-14-4-9-2-12(6-14,23-10(26)15(17,18)19)5-13(3-9,7-14)24-11(27)16(20,21)22/h9H,2-7H2,1H3,(H,23,26)(H,24,27)