butan-1-amine; 2-ethylhexanoic acid

Systemtic Name: butan-1-amine; 2-ethylhexanoic acid Openeye Name: butan-1-amine; 2-ethylhexanoic acid CAS Name: 1-butanamine; 2-ethylhexanoic acid IUPAC Name: butan-1-amine; 2-ethylhexanoic acid Traditional Name: butylamine; 2-ethylhexanoic acid Formula: C12H27NO2 MolecularWeight: 217.34828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)O.CCCCN

Isomeric SMILES

CCCCC(CC)C(=O)O.CCCCN

InChI

InChI=1S/C8H16O2.C4H11N/c1-3-5-6-7(4-2)8(9)10;1-2-3-4-5/h7H,3-6H2,1-2H3,(H,9,10);2-5H2,1H3