methyl 2-(4-isothiocyanato-3-methoxy-phenoxy)ethanoate

Systemtic Name: methyl 2-(4-isothiocyanato-3-methoxy-phenoxy)ethanoate Openeye Name: methyl 2-(4-isothiocyanato-3-methoxy-phenoxy)acetate CAS Name: 2-(4-isothiocyanato-3-methoxyphenoxy)acetic acid methyl ester IUPAC Name: methyl 2-(4-isothiocyanato-3-methoxyphenoxy)acetate Traditional Name: 2-(4-isothiocyanato-3-methoxy-phenoxy)acetic acid methyl ester Formula: C11H11NO4S MolecularWeight: 253.27434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)OCC(=O)OC)N=C=S

Isomeric SMILES

COC1=C(C=CC(=C1)OCC(=O)OC)N=C=S

InChI

InChI=1S/C11H11NO4S/c1-14-10-5-8(16-6-11(13)15-2)3-4-9(10)12-7-17/h3-5H,6H2,1-2H3