1-(diethoxyphosphorylmethyl)-4-isothiocyanato-benzene

Systemtic Name: 1-(diethoxyphosphorylmethyl)-4-isothiocyanato-benzene Openeye Name: 1-(diethoxyphosphorylmethyl)-4-isothiocyanato-benzene CAS Name: 1-(diethoxyphosphorylmethyl)-4-isothiocyanatobenzene IUPAC Name: 1-(diethoxyphosphorylmethyl)-4-isothiocyanatobenzene Traditional Name: 1-(diethoxyphosphorylmethyl)-4-isothiocyanato-benzene Formula: C12H16NO3PS MolecularWeight: 285.299101

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CC1=CC=C(C=C1)N=C=S)OCC

Isomeric SMILES

CCOP(=O)(CC1=CC=C(C=C1)N=C=S)OCC

InChI

InChI=1S/C12H16NO3PS/c1-3-15-17(14,16-4-2)9-11-5-7-12(8-6-11)13-10-18/h5-8H,3-4,9H2,1-2H3