ethanoic acid; ethyl 3-azanyl-5-methyl-hexanoate

Systemtic Name: ethanoic acid; ethyl 3-azanyl-5-methyl-hexanoate Openeye Name: acetic acid; ethyl 3-amino-5-methyl-hexanoate CAS Name: acetic acid; 3-amino-5-methylhexanoic acid ethyl ester IUPAC Name: acetic acid; ethyl 3-amino-5-methylhexanoate Traditional Name: acetic acid; 3-amino-5-methyl-hexanoic acid ethyl ester Formula: C11H23NO4 MolecularWeight: 233.30462

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(CC(C)C)N.CC(=O)O

Isomeric SMILES

CCOC(=O)CC(CC(C)C)N.CC(=O)O

InChI

InChI=1S/C9H19NO2.C2H4O2/c1-4-12-9(11)6-8(10)5-7(2)3;1-2(3)4/h7-8H,4-6,10H2,1-3H3;1H3,(H,3,4)