[2-[(2-methoxydibenzofuran-3-yl)amino]-2-oxidanylidene-ethyl] 2-(3-bromanyl-1-adamantyl)ethanoate

Systemtic Name: [2-[(2-methoxydibenzofuran-3-yl)amino]-2-oxidanylidene-ethyl] 2-(3-bromanyl-1-adamantyl)ethanoate Openeye Name: [2-[(2-methoxydibenzofuran-3-yl)amino]-2-oxo-ethyl] 2-(3-bromo-1-adamantyl)acetate CAS Name: 2-(3-bromo-1-adamantyl)acetic acid [2-[(2-methoxy-3-dibenzofuranyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(2-methoxydibenzofuran-3-yl)amino]-2-oxoethyl] 2-(3-bromo-1-adamantyl)acetate Traditional Name: 2-(3-bromo-1-adamantyl)acetic acid [2-keto-2-[(2-methoxydibenzofuran-3-yl)amino]ethyl] ester Formula: C27H28BrNO5 MolecularWeight: 526.41892

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C3=CC=CC=C3O2)NC(=O)COC(=O)CC45CC6CC(C4)CC(C6)(C5)Br

Isomeric SMILES

COC1=C(C=C2C(=C1)C3=CC=CC=C3O2)NC(=O)COC(=O)CC45CC6CC(C4)CC(C6)(C5)Br

InChI

InChI=1S/C27H28BrNO5/c1-32-23-7-19-18-4-2-3-5-21(18)34-22(19)8-20(23)29-24(30)14-33-25(31)13-26-9-16-6-17(10-26)12-27(28,11-16)15-26/h2-5,7-8,16-17H,6,9-15H2,1H3,(H,29,30)