1-(furan-2-yl)-3-(2-morpholin-4-ium-4-ylethoxy)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile

Systemtic Name: 1-(furan-2-yl)-3-(2-morpholin-4-ium-4-ylethoxy)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Openeye Name: 1-(2-furyl)-3-(2-morpholin-4-ium-4-ylethoxy)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile CAS Name: 1-(2-furanyl)-3-[2-(4-morpholin-4-iumyl)ethoxy]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile IUPAC Name: 1-(furan-2-yl)-3-(2-morpholin-4-ium-4-ylethoxy)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Traditional Name: 1-(2-furyl)-3-(2-morpholin-4-ium-4-ylethoxy)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Formula: C20H24N3O3+ MolecularWeight: 354.42286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(N=C(C(=C2C1)C#N)OCC[NH+]3CCOCC3)C4=CC=CO4

Isomeric SMILES

C1CCC2=C(N=C(C(=C2C1)C#N)OCC[NH+]3CCOCC3)C4=CC=CO4

InChI

InChI=1S/C20H23N3O3/c21-14-17-15-4-1-2-5-16(15)19(18-6-3-10-25-18)22-20(17)26-13-9-23-7-11-24-12-8-23/h3,6,10H,1-2,4-5,7-9,11-13H2/p+1