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4-isothiocyanato-3-methyl-piperidine-1-carboxylate

4-isothiocyanato-3-methyl-piperidine-1-carboxylate

Systemtic Name:4-isothiocyanato-3-methyl-piperidine-1-carboxylate
Openeye Name:4-isothiocyanato-3-methyl-piperidine-1-carboxylate
CAS Name:4-isothiocyanato-3-methyl-1-piperidinecarboxylate
IUPAC Name:4-isothiocyanato-3-methylpiperidine-1-carboxylate
Traditional Name:4-isothiocyanato-3-methyl-piperidine-1-carboxylate
Formula: C8H11N2O2S-
MolecularWeight: 199.25014
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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)/p-1


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