4-ethyl-5-methyl-azepane-2-carboxylic acid

Systemtic Name: 4-ethyl-5-methyl-azepane-2-carboxylic acid Openeye Name: 4-ethyl-5-methyl-azepane-2-carboxylic acid CAS Name: 4-ethyl-5-methyl-2-azepanecarboxylic acid IUPAC Name: 4-ethyl-5-methylazepane-2-carboxylic acid Traditional Name: 4-ethyl-5-methyl-azepane-2-carboxylic acid Formula: C10H19NO2 MolecularWeight: 185.26336

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC(NCCC1C)C(=O)O

Isomeric SMILES

CCC1CC(NCCC1C)C(=O)O

InChI

InChI=1S/C10H19NO2/c1-3-8-6-9(10(12)13)11-5-4-7(8)2/h7-9,11H,3-6H2,1-2H3,(H,12,13)