2-(5-methylhexan-2-ylcarbamoyl)bicyclo[2.2.1]hept-5-ene-3-carboxylic acid

Systemtic Name: 2-(5-methylhexan-2-ylcarbamoyl)bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Openeye Name: 2-(1,4-dimethylpentylcarbamoyl)bicyclo[2.2.1]hept-5-ene-3-carboxylic acid CAS Name: 2-[(5-methylhexan-2-ylamino)-oxomethyl]-3-bicyclo[2.2.1]hept-5-enecarboxylic acid IUPAC Name: 2-(5-methylhexan-2-ylcarbamoyl)bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Traditional Name: 2-(1,4-dimethylpentylcarbamoyl)bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Formula: C16H25NO3 MolecularWeight: 279.3746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)NC(=O)C1C2CC(C1C(=O)O)C=C2

Isomeric SMILES

CC(C)CCC(C)NC(=O)C1C2CC(C1C(=O)O)C=C2

InChI

InChI=1S/C16H25NO3/c1-9(2)4-5-10(3)17-15(18)13-11-6-7-12(8-11)14(13)16(19)20/h6-7,9-14H,4-5,8H2,1-3H3,(H,17,18)(H,19,20)