4-[2-(1,3-benzodioxol-5-ylmethylamino)ethyl]benzene-1,2-diol

Systemtic Name: 4-[2-(1,3-benzodioxol-5-ylmethylamino)ethyl]benzene-1,2-diol Openeye Name: 4-[2-(1,3-benzodioxol-5-ylmethylamino)ethyl]benzene-1,2-diol CAS Name: 4-[2-(1,3-benzodioxol-5-ylmethylamino)ethyl]benzene-1,2-diol IUPAC Name: 4-[2-(1,3-benzodioxol-5-ylmethylamino)ethyl]benzene-1,2-diol Traditional Name: 4-[2-(piperonylamino)ethyl]pyrocatechol Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNCCC3=CC(=C(C=C3)O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNCCC3=CC(=C(C=C3)O)O

InChI

InChI=1S/C16H17NO4/c18-13-3-1-11(7-14(13)19)5-6-17-9-12-2-4-15-16(8-12)21-10-20-15/h1-4,7-8,17-19H,5-6,9-10H2