5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-1,3-benzodioxol-4-amine

Systemtic Name: 5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-1,3-benzodioxol-4-amine Openeye Name: 5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-1,3-benzodioxol-4-amine CAS Name: 5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-1,3-benzodioxol-4-amine IUPAC Name: 5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-1,3-benzodioxol-4-amine Traditional Name: [5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-1,3-benzodioxol-4-yl]amine Formula: C18H20N2O4 MolecularWeight: 328.3624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(NCCC2=C1)C3=C(C4=C(C=C3)OCO4)N)OC

Isomeric SMILES

COC1=C(C=C2C(NCCC2=C1)C3=C(C4=C(C=C3)OCO4)N)OC

InChI

InChI=1S/C18H20N2O4/c1-21-14-7-10-5-6-20-17(12(10)8-15(14)22-2)11-3-4-13-18(16(11)19)24-9-23-13/h3-4,7-8,17,20H,5-6,9,19H2,1-2H3