2-(3-bromanylphenoxy)ethyl 2-(1-adamantylcarbonylamino)ethanoate

Systemtic Name: 2-(3-bromanylphenoxy)ethyl 2-(1-adamantylcarbonylamino)ethanoate Openeye Name: 2-(3-bromophenoxy)ethyl 2-(adamantane-1-carbonylamino)acetate CAS Name: 2-[[1-adamantyl(oxo)methyl]amino]acetic acid 2-(3-bromophenoxy)ethyl ester IUPAC Name: 2-(3-bromophenoxy)ethyl 2-(adamantane-1-carbonylamino)acetate Traditional Name: 2-(adamantane-1-carbonylamino)acetic acid 2-(3-bromophenoxy)ethyl ester Formula: C21H26BrNO4 MolecularWeight: 436.33944

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCC(=O)OCCOC4=CC(=CC=C4)Br

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCC(=O)OCCOC4=CC(=CC=C4)Br

InChI

InChI=1S/C21H26BrNO4/c22-17-2-1-3-18(9-17)26-4-5-27-19(24)13-23-20(25)21-10-14-6-15(11-21)8-16(7-14)12-21/h1-3,9,14-16H,4-8,10-13H2,(H,23,25)