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

Systemtic Name: 1-(furan-2-yl)-3-(2-morpholin-4-ium-4-ylethylamino)-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile Openeye Name: 1-(2-furyl)-3-(2-morpholin-4-ium-4-ylethylamino)-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile CAS Name: 1-(2-furanyl)-3-[2-(4-morpholin-4-iumyl)ethylamino]-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile IUPAC Name: 1-(furan-2-yl)-3-(2-morpholin-4-ium-4-ylethylamino)-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile Traditional Name: 1-(2-furyl)-3-(2-morpholin-4-ium-4-ylethylamino)-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile Formula: C20H26N4O2+2 MolecularWeight: 354.44604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N4O2/c21-14-17-15-4-1-2-5-16(15)19(18-6-3-11-26-18)23-20(17)22-7-8-24-9-12-25-13-10-24/h3,6,11H,1-2,4-5,7-10,12-13H2,(H,22,23)/p+2