2-[[4-(1-adamantyl)phenyl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[4-(1-adamantyl)phenyl]carbonylamino]ethanoic acid Openeye Name: 2-[[4-(1-adamantyl)benzoyl]amino]acetic acid CAS Name: 2-[[[4-(1-adamantyl)phenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[4-(1-adamantyl)benzoyl]amino]acetic acid Traditional Name: 2-[[4-(1-adamantyl)benzoyl]amino]acetic acid Formula: C19H23NO3 MolecularWeight: 313.39082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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