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4-isothiocyanato-3-methyl-piperidine-1-carboxylic acid

4-isothiocyanato-3-methyl-piperidine-1-carboxylic acid

Systemtic Name:4-isothiocyanato-3-methyl-piperidine-1-carboxylic acid
Openeye Name:4-isothiocyanato-3-methyl-piperidine-1-carboxylic acid
CAS Name:4-isothiocyanato-3-methyl-1-piperidinecarboxylic acid
IUPAC Name:4-isothiocyanato-3-methylpiperidine-1-carboxylic acid
Traditional Name:4-isothiocyanato-3-methyl-piperidine-1-carboxylic acid
Formula: C8H12N2O2S
MolecularWeight: 200.25808
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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCC1N=C=S)C(=O)O


Isomeric SMILES

CC1CN(CCC1N=C=S)C(=O)O


InChI

InChI=1S/C8H12N2O2S/c1-6-4-10(8(11)12)3-2-7(6)9-5-13/h6-7H,2-4H2,1H3,(H,11,12)


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