2-(2-adamantylcarbamoyl)benzoic acid

Systemtic Name: 2-(2-adamantylcarbamoyl)benzoic acid Openeye Name: 2-(2-adamantylcarbamoyl)benzoic acid CAS Name: 2-[(2-adamantylamino)-oxomethyl]benzoic acid IUPAC Name: 2-(2-adamantylcarbamoyl)benzoic acid Traditional Name: 2-(2-adamantylcarbamoyl)benzoic acid Formula: C18H21NO3 MolecularWeight: 299.36424

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NC(=O)C4=CC=CC=C4C(=O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NC(=O)C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C18H21NO3/c20-17(14-3-1-2-4-15(14)18(21)22)19-16-12-6-10-5-11(8-12)9-13(16)7-10/h1-4,10-13,16H,5-9H2,(H,19,20)(H,21,22)