6-azanyl-2-ethyl-8-(3,4,5-trimethoxyphenyl)-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile

Systemtic Name: 6-azanyl-2-ethyl-8-(3,4,5-trimethoxyphenyl)-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile Openeye Name: 6-amino-2-ethyl-8-(3,4,5-trimethoxyphenyl)-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile CAS Name: 6-amino-2-ethyl-8-(3,4,5-trimethoxyphenyl)-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile IUPAC Name: 6-amino-2-ethyl-8-(3,4,5-trimethoxyphenyl)-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile Traditional Name: 6-amino-2-ethyl-8-(3,4,5-trimethoxyphenyl)-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile Formula: C23H25N5O3 MolecularWeight: 419.4763

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC=C2C(C1)C(C(C(=C2C#N)N)(C#N)C#N)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CCN1CC=C2C(C1)C(C(C(=C2C#N)N)(C#N)C#N)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C23H25N5O3/c1-5-28-7-6-15-16(10-24)22(27)23(12-25,13-26)20(17(15)11-28)14-8-18(29-2)21(31-4)19(9-14)30-3/h6,8-9,17,20H,5,7,11,27H2,1-4H3