4-methylpentyl 2-(butylamino)-2-oxidanylidene-ethanoate

Systemtic Name: 4-methylpentyl 2-(butylamino)-2-oxidanylidene-ethanoate Openeye Name: isohexyl 2-(butylamino)-2-oxo-acetate CAS Name: 2-(butylamino)-2-oxoacetic acid 4-methylpentyl ester IUPAC Name: 4-methylpentyl 2-(butylamino)-2-oxoacetate Traditional Name: 2-(butylamino)-2-keto-acetic acid isohexyl ester Formula: C12H23NO3 MolecularWeight: 229.31592

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(=O)OCCCC(C)C

Isomeric SMILES

CCCCNC(=O)C(=O)OCCCC(C)C

InChI

InChI=1S/C12H23NO3/c1-4-5-8-13-11(14)12(15)16-9-6-7-10(2)3/h10H,4-9H2,1-3H3,(H,13,14)