2-(butylamino)-3-(chloromethylsulfanyl)propanoic acid; methanal

Systemtic Name: 2-(butylamino)-3-(chloromethylsulfanyl)propanoic acid; methanal Openeye Name: 2-(butylamino)-3-(chloromethylsulfanyl)propanoic acid; formaldehyde CAS Name: 2-(butylamino)-3-(chloromethylthio)propanoic acid; formaldehyde IUPAC Name: 2-(butylamino)-3-(chloromethylsulfanyl)propanoic acid; formaldehyde Traditional Name: 2-(butylamino)-3-(chloromethylthio)propionic acid; formaldehyde Formula: C9H18ClNO3S MolecularWeight: 255.76212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(CSCCl)C(=O)O.C=O

Isomeric SMILES

CCCCNC(CSCCl)C(=O)O.C=O

InChI

InChI=1S/C8H16ClNO2S.CH2O/c1-2-3-4-10-7(8(11)12)5-13-6-9;1-2/h7,10H,2-6H2,1H3,(H,11,12);1H2