2-[1-adamantylcarbonyl(methyl)amino]benzoic acid

Systemtic Name: 2-[1-adamantylcarbonyl(methyl)amino]benzoic acid Openeye Name: 2-[adamantane-1-carbonyl(methyl)amino]benzoic acid CAS Name: 2-[[1-adamantyl(oxo)methyl]-methylamino]benzoic acid IUPAC Name: 2-[adamantane-1-carbonyl(methyl)amino]benzoic acid Traditional Name: 2-[adamantane-1-carbonyl(methyl)amino]benzoic acid Formula: C19H23NO3 MolecularWeight: 313.39082

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)O)C(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)O)C(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C19H23NO3/c1-20(16-5-3-2-4-15(16)17(21)22)18(23)19-9-12-6-13(10-19)8-14(7-12)11-19/h2-5,12-14H,6-11H2,1H3,(H,21,22)