6-azanyl-8-cyclohex-3-en-1-yl-2-(phenylmethyl)-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile

Systemtic Name: 6-azanyl-8-cyclohex-3-en-1-yl-2-(phenylmethyl)-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile Openeye Name: 6-amino-2-benzyl-8-cyclohex-3-en-1-yl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile CAS Name: 6-amino-8-(1-cyclohex-3-enyl)-2-(phenylmethyl)-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile IUPAC Name: 6-amino-2-benzyl-8-cyclohex-3-en-1-yl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile Traditional Name: 6-amino-2-benzyl-8-cyclohex-3-en-1-yl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile Formula: C25H25N5 MolecularWeight: 395.4995

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)C2C3CN(CC=C3C(=C(C2(C#N)C#N)N)C#N)CC4=CC=CC=C4

Isomeric SMILES

C1CC(CC=C1)C2C3CN(CC=C3C(=C(C2(C#N)C#N)N)C#N)CC4=CC=CC=C4

InChI

InChI=1S/C25H25N5/c26-13-21-20-11-12-30(14-18-7-3-1-4-8-18)15-22(20)23(19-9-5-2-6-10-19)25(16-27,17-28)24(21)29/h1-5,7-8,11,19,22-23H,6,9-10,12,14-15,29H2