3-(aminomethyl)-3-[3-(3-azanylphenoxy)propyl]-2H-1,4-benzodioxin-5-ol

Systemtic Name: 3-(aminomethyl)-3-[3-(3-azanylphenoxy)propyl]-2H-1,4-benzodioxin-5-ol Openeye Name: 3-(aminomethyl)-3-[3-(3-aminophenoxy)propyl]-2H-1,4-benzodioxin-5-ol CAS Name: 3-(aminomethyl)-3-[3-(3-aminophenoxy)propyl]-2H-1,4-benzodioxin-5-ol IUPAC Name: 3-(aminomethyl)-3-[3-(3-aminophenoxy)propyl]-2H-1,4-benzodioxin-5-ol Traditional Name: 3-(aminomethyl)-3-[3-(3-aminophenoxy)propyl]-2H-1,4-benzodioxin-5-ol Formula: C18H22N2O4 MolecularWeight: 330.37828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C(O1)C=CC=C2O)(CCCOC3=CC=CC(=C3)N)CN

Isomeric SMILES

C1C(OC2=C(O1)C=CC=C2O)(CCCOC3=CC=CC(=C3)N)CN

InChI

InChI=1S/C18H22N2O4/c19-11-18(8-3-9-22-14-5-1-4-13(20)10-14)12-23-16-7-2-6-15(21)17(16)24-18/h1-2,4-7,10,21H,3,8-9,11-12,19-20H2