methyl 2-[(4-isothiocyanato-5,6,7,8-tetrahydronaphthalen-1-yl)oxy]ethanoate

Systemtic Name: methyl 2-[(4-isothiocyanato-5,6,7,8-tetrahydronaphthalen-1-yl)oxy]ethanoate Openeye Name: methyl 2-(8-isothiocyanatotetralin-5-yl)oxyacetate CAS Name: 2-[(4-isothiocyanato-5,6,7,8-tetrahydronaphthalen-1-yl)oxy]acetic acid methyl ester IUPAC Name: methyl 2-[(4-isothiocyanato-5,6,7,8-tetrahydronaphthalen-1-yl)oxy]acetate Traditional Name: 2-(8-isothiocyanatotetralin-5-yl)oxyacetic acid methyl ester Formula: C14H15NO3S MolecularWeight: 277.3388

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=C2CCCCC2=C(C=C1)N=C=S

Isomeric SMILES

COC(=O)COC1=C2CCCCC2=C(C=C1)N=C=S

InChI

InChI=1S/C14H15NO3S/c1-17-14(16)8-18-13-7-6-12(15-9-19)10-4-2-3-5-11(10)13/h6-7H,2-5,8H2,1H3