sodium; azanyl 2-propylpentanoate; 2-propylpentanoate

Systemtic Name: sodium; azanyl 2-propylpentanoate; 2-propylpentanoate Openeye Name: sodium; amino 2-propylpentanoate; 2-propylpentanoate CAS Name: sodium; 2-propylpentanoate; 2-propylpentanoic acid amino ester IUPAC Name: sodium; amino 2-propylpentanoate; 2-propylpentanoate Traditional Name: sodium; 2-propylvalerate; 2-propylvaleric acid amino ester Formula: C16H32NNaO4 MolecularWeight: 325.41935

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)[O-].CCCC(CCC)C(=O)ON.[Na+]

Isomeric SMILES

CCCC(CCC)C(=O)[O-].CCCC(CCC)C(=O)ON.[Na+]

InChI

InChI=1S/C8H17NO2.C8H16O2.Na/c1-3-5-7(6-4-2)8(10)11-9;1-3-5-7(6-4-2)8(9)10;/h7H,3-6,9H2,1-2H3;7H,3-6H2,1-2H3,(H,9,10);/q;;+1/p-1