3-(1-adamantylmethylcarbamoyl)furan-2-carboxylic acid

Systemtic Name: 3-(1-adamantylmethylcarbamoyl)furan-2-carboxylic acid Openeye Name: 3-(1-adamantylmethylcarbamoyl)furan-2-carboxylic acid CAS Name: 3-[(1-adamantylmethylamino)-oxomethyl]-2-furancarboxylic acid IUPAC Name: 3-(1-adamantylmethylcarbamoyl)furan-2-carboxylic acid Traditional Name: 3-(1-adamantylmethylcarbamoyl)-2-furoic acid Formula: C17H21NO4 MolecularWeight: 303.35294

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=C(OC=C4)C(=O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=C(OC=C4)C(=O)O

InChI

InChI=1S/C17H21NO4/c19-15(13-1-2-22-14(13)16(20)21)18-9-17-6-10-3-11(7-17)5-12(4-10)8-17/h1-2,10-12H,3-9H2,(H,18,19)(H,20,21)