butanoate; N,N-diethylethanamine; heptane

Systemtic Name: butanoate; N,N-diethylethanamine; heptane Openeye Name: butanoate; N,N-diethylethanamine; heptane CAS Name: butanoate; N,N-diethylethanamine; heptane IUPAC Name: butanoate; N,N-diethylethanamine; heptane Traditional Name: butyrate; n-heptane; triethylamine Formula: C17H38NO2- MolecularWeight: 288.48912

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC.CCCC(=O)[O-].CCN(CC)CC

Isomeric SMILES

CCCCCCC.CCCC(=O)[O-].CCN(CC)CC

InChI

InChI=1S/C7H16.C6H15N.C4H8O2/c1-3-5-7-6-4-2;1-4-7(5-2)6-3;1-2-3-4(5)6/h3-7H2,1-2H3;4-6H2,1-3H3;2-3H2,1H3,(H,5,6)/p-1