[2-(2-azanylethyl)-4,5-bis(oxidanyl)phenyl] thiocyanate

Systemtic Name: [2-(2-azanylethyl)-4,5-bis(oxidanyl)phenyl] thiocyanate Openeye Name: [2-(2-aminoethyl)-4,5-dihydroxy-phenyl] thiocyanate CAS Name: thiocyanic acid [2-(2-aminoethyl)-4,5-dihydroxyphenyl] ester IUPAC Name: [2-(2-aminoethyl)-4,5-dihydroxyphenyl] thiocyanate Traditional Name: thiocyanic acid [2-(2-aminoethyl)-4,5-dihydroxy-phenyl] ester Formula: C9H10N2O2S MolecularWeight: 210.2529

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1O)O)SC#N)CCN

Isomeric SMILES

C1=C(C(=CC(=C1O)O)SC#N)CCN

InChI

InChI=1S/C9H10N2O2S/c10-2-1-6-3-7(12)8(13)4-9(6)14-5-11/h3-4,12-13H,1-2,10H2