methyl 4-[butyl(nitroso)amino]-3-oxidanyl-butanoate

Systemtic Name: methyl 4-[butyl(nitroso)amino]-3-oxidanyl-butanoate Openeye Name: methyl 4-[butyl(nitroso)amino]-3-hydroxy-butanoate CAS Name: 4-[butyl(nitroso)amino]-3-hydroxybutanoic acid methyl ester IUPAC Name: methyl 4-[butyl(nitroso)amino]-3-hydroxybutanoate Traditional Name: 4-[butyl(nitroso)amino]-3-hydroxy-butyric acid methyl ester Formula: C9H18N2O4 MolecularWeight: 218.25022

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(CC(=O)OC)O)N=O

Isomeric SMILES

CCCCN(CC(CC(=O)OC)O)N=O

InChI

InChI=1S/C9H18N2O4/c1-3-4-5-11(10-14)7-8(12)6-9(13)15-2/h8,12H,3-7H2,1-2H3