3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile

Systemtic Name: 3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Openeye Name: 3-[4-(furan-2-carbonyl)piperazin-1-yl]-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile CAS Name: 3-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile IUPAC Name: 3-[4-(furan-2-carbonyl)piperazin-1-yl]-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Traditional Name: 3-[4-(2-furoyl)piperazino]-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Formula: C20H22N4O2 MolecularWeight: 350.41428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCCCC2=C(C(=N1)N3CCN(CC3)C(=O)C4=CC=CO4)C#N

Isomeric SMILES

CC1=C2CCCCC2=C(C(=N1)N3CCN(CC3)C(=O)C4=CC=CO4)C#N

InChI

InChI=1S/C20H22N4O2/c1-14-15-5-2-3-6-16(15)17(13-21)19(22-14)23-8-10-24(11-9-23)20(25)18-7-4-12-26-18/h4,7,12H,2-3,5-6,8-11H2,1H3