1-(butanoylamino)cycloheptane-1-carboxylic acid

Systemtic Name: 1-(butanoylamino)cycloheptane-1-carboxylic acid Openeye Name: 1-(butanoylamino)cycloheptanecarboxylic acid CAS Name: 1-(1-oxobutylamino)-1-cycloheptanecarboxylic acid IUPAC Name: 1-(butanoylamino)cycloheptane-1-carboxylic acid Traditional Name: 1-butyramidocycloheptanecarboxylic acid Formula: C12H21NO3 MolecularWeight: 227.30004

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1(CCCCCC1)C(=O)O

Isomeric SMILES

CCCC(=O)NC1(CCCCCC1)C(=O)O

InChI

InChI=1S/C12H21NO3/c1-2-7-10(14)13-12(11(15)16)8-5-3-4-6-9-12/h2-9H2,1H3,(H,13,14)(H,15,16)