(8R,8aR)-6-azanylidene-2-methyl-8-phenethyl-3,5,8,8a-tetrahydro-1H-isoquinoline-5,7,7-tricarbonitrile

Systemtic Name: (8R,8aR)-6-azanylidene-2-methyl-8-phenethyl-3,5,8,8a-tetrahydro-1H-isoquinoline-5,7,7-tricarbonitrile Openeye Name: (8R,8aR)-6-imino-2-methyl-8-phenethyl-3,5,8,8a-tetrahydro-1H-isoquinoline-5,7,7-tricarbonitrile CAS Name: (8R,8aR)-6-imino-2-methyl-8-phenethyl-3,5,8,8a-tetrahydro-1H-isoquinoline-5,7,7-tricarbonitrile IUPAC Name: (8R,8aR)-6-imino-2-methyl-8-phenethyl-3,5,8,8a-tetrahydro-1H-isoquinoline-5,7,7-tricarbonitrile Traditional Name: (8R,8aR)-6-imino-2-methyl-8-phenethyl-3,5,8,8a-tetrahydro-1H-isoquinoline-5,7,7-tricarbonitrile Formula: C21H21N5 MolecularWeight: 343.42494

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC=C2C(C1)C(C(C(=N)C2C#N)(C#N)C#N)CCC3=CC=CC=C3

Isomeric SMILES

CN1CC=C2[C@H](C1)[C@H](C(C(=N)C2C#N)(C#N)C#N)CCC3=CC=CC=C3

InChI

InChI=1S/C21H21N5/c1-26-10-9-16-17(11-22)20(25)21(13-23,14-24)19(18(16)12-26)8-7-15-5-3-2-4-6-15/h2-6,9,17-19,25H,7-8,10,12H2,1H3/t17?,18-,19+/m0/s1