4-[[2-(aminomethyl)-2,3-dihydro-1,4-benzodioxin-3-yl]-pyridin-3-yl-methyl]benzene-1,3-diol

Systemtic Name: 4-[[2-(aminomethyl)-2,3-dihydro-1,4-benzodioxin-3-yl]-pyridin-3-yl-methyl]benzene-1,3-diol Openeye Name: 4-[[2-(aminomethyl)-2,3-dihydro-1,4-benzodioxin-3-yl]-(3-pyridyl)methyl]benzene-1,3-diol CAS Name: 4-[[2-(aminomethyl)-2,3-dihydro-1,4-benzodioxin-3-yl]-(3-pyridinyl)methyl]benzene-1,3-diol IUPAC Name: 4-[[2-(aminomethyl)-2,3-dihydro-1,4-benzodioxin-3-yl]-pyridin-3-ylmethyl]benzene-1,3-diol Traditional Name: 4-[[2-(aminomethyl)-2,3-dihydro-1,4-benzodioxin-3-yl]-(3-pyridyl)methyl]resorcinol Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)OC(C(O2)C(C3=CN=CC=C3)C4=C(C=C(C=C4)O)O)CN

Isomeric SMILES

C1=CC=C2C(=C1)OC(C(O2)C(C3=CN=CC=C3)C4=C(C=C(C=C4)O)O)CN

InChI

InChI=1S/C21H20N2O4/c22-11-19-21(27-18-6-2-1-5-17(18)26-19)20(13-4-3-9-23-12-13)15-8-7-14(24)10-16(15)25/h1-10,12,19-21,24-25H,11,22H2