1-(2-methylpropyl)-3-(2-oxidanylidene-2-piperidin-1-yl-ethoxy)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile

Systemtic Name: 1-(2-methylpropyl)-3-(2-oxidanylidene-2-piperidin-1-yl-ethoxy)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Openeye Name: 1-isobutyl-3-[2-oxo-2-(1-piperidyl)ethoxy]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile CAS Name: 1-(2-methylpropyl)-3-[2-oxo-2-(1-piperidinyl)ethoxy]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile IUPAC Name: 1-(2-methylpropyl)-3-(2-oxo-2-piperidin-1-ylethoxy)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Traditional Name: 1-isobutyl-3-(2-keto-2-piperidino-ethoxy)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Formula: C21H29N3O2 MolecularWeight: 355.47386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C2CCCCC2=C(C(=N1)OCC(=O)N3CCCCC3)C#N

Isomeric SMILES

CC(C)CC1=C2CCCCC2=C(C(=N1)OCC(=O)N3CCCCC3)C#N

InChI

InChI=1S/C21H29N3O2/c1-15(2)12-19-17-9-5-4-8-16(17)18(13-22)21(23-19)26-14-20(25)24-10-6-3-7-11-24/h15H,3-12,14H2,1-2H3