4-[(2-thiophen-2-ylethylamino)methyl]benzene-1,2-diol

Systemtic Name: 4-[(2-thiophen-2-ylethylamino)methyl]benzene-1,2-diol Openeye Name: 4-[[2-(2-thienyl)ethylamino]methyl]benzene-1,2-diol CAS Name: 4-[(2-thiophen-2-ylethylamino)methyl]benzene-1,2-diol IUPAC Name: 4-[(2-thiophen-2-ylethylamino)methyl]benzene-1,2-diol Traditional Name: 4-[[2-(2-thienyl)ethylamino]methyl]pyrocatechol Formula: C13H15NO2S MolecularWeight: 249.3287

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CCNCC2=CC(=C(C=C2)O)O

Isomeric SMILES

C1=CSC(=C1)CCNCC2=CC(=C(C=C2)O)O

InChI

InChI=1S/C13H15NO2S/c15-12-4-3-10(8-13(12)16)9-14-6-5-11-2-1-7-17-11/h1-4,7-8,14-16H,5-6,9H2