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5-azanyl-8-(2,3-dimethoxyphenyl)-2-ethyl-1,3,8,8a-tetrahydroisoquinoline-6,7,7-tricarbonitrile
5-azanyl-8-(2,3-dimethoxyphenyl)-2-ethyl-1,3,8,8a-tetrahydroisoquinoline-6,7,7-tricarbonitrile
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Descriptors Computed from Structure
Canonical SMILES:
CCN1CC=C2C(C1)C(C(C(=C2N)C#N)(C#N)C#N)C3=C(C(=CC=C3)OC)OC
Isomeric SMILES
CCN1CC=C2C(C1)C(C(C(=C2N)C#N)(C#N)C#N)C3=C(C(=CC=C3)OC)OC
InChI
InChI=1S/C22H23N5O2/c1-4-27-9-8-14-16(11-27)19(15-6-5-7-18(28-2)21(15)29-3)22(12-24,13-25)17(10-23)20(14)26/h5-8,16,19H,4,9,11,26H2,1-3H3
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