1-(furan-2-yl)-3-(oxolan-2-ylmethylamino)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile

Systemtic Name: 1-(furan-2-yl)-3-(oxolan-2-ylmethylamino)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Openeye Name: 1-(2-furyl)-3-(tetrahydrofuran-2-ylmethylamino)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile CAS Name: 1-(2-furanyl)-3-(2-oxolanylmethylamino)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile IUPAC Name: 1-(furan-2-yl)-3-(oxolan-2-ylmethylamino)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Traditional Name: 1-(2-furyl)-3-(tetrahydrofurfurylamino)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Formula: C19H21N3O2 MolecularWeight: 323.38894

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(N=C(C(=C2C1)C#N)NCC3CCCO3)C4=CC=CO4

Isomeric SMILES

C1CCC2=C(N=C(C(=C2C1)C#N)NCC3CCCO3)C4=CC=CO4

InChI

InChI=1S/C19H21N3O2/c20-11-16-14-6-1-2-7-15(14)18(17-8-4-10-24-17)22-19(16)21-12-13-5-3-9-23-13/h4,8,10,13H,1-3,5-7,9,12H2,(H,21,22)