2-[2-(4-azanylcyclohexyl)ethyl]-4,4-dimethyl-1,3-dihydroisoquinoline-6-carbonitrile

Systemtic Name: 2-[2-(4-azanylcyclohexyl)ethyl]-4,4-dimethyl-1,3-dihydroisoquinoline-6-carbonitrile Openeye Name: 2-[2-(4-aminocyclohexyl)ethyl]-4,4-dimethyl-1,3-dihydroisoquinoline-6-carbonitrile CAS Name: 2-[2-(4-aminocyclohexyl)ethyl]-4,4-dimethyl-1,3-dihydroisoquinoline-6-carbonitrile IUPAC Name: 2-[2-(4-aminocyclohexyl)ethyl]-4,4-dimethyl-1,3-dihydroisoquinoline-6-carbonitrile Traditional Name: 2-[2-(4-aminocyclohexyl)ethyl]-4,4-dimethyl-1,3-dihydroisoquinoline-6-carbonitrile Formula: C20H29N3 MolecularWeight: 311.46436

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CC2=C1C=C(C=C2)C#N)CCC3CCC(CC3)N)C

Isomeric SMILES

CC1(CN(CC2=C1C=C(C=C2)C#N)CCC3CCC(CC3)N)C

InChI

InChI=1S/C20H29N3/c1-20(2)14-23(10-9-15-4-7-18(22)8-5-15)13-17-6-3-16(12-21)11-19(17)20/h3,6,11,15,18H,4-5,7-10,13-14,22H2,1-2H3