4-[(1-adamantylcarbonylamino)methyl]benzoic acid

Systemtic Name: 4-[(1-adamantylcarbonylamino)methyl]benzoic acid Openeye Name: 4-[(adamantane-1-carbonylamino)methyl]benzoic acid CAS Name: 4-[[[1-adamantyl(oxo)methyl]amino]methyl]benzoic acid IUPAC Name: 4-[(adamantane-1-carbonylamino)methyl]benzoic acid Traditional Name: 4-[(adamantane-1-carbonylamino)methyl]benzoic acid Formula: C19H23NO3 MolecularWeight: 313.39082

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C19H23NO3/c21-17(22)16-3-1-12(2-4-16)11-20-18(23)19-8-13-5-14(9-19)7-15(6-13)10-19/h1-4,13-15H,5-11H2,(H,20,23)(H,21,22)