6-azanyl-8-(4-methoxyphenyl)-2-methyl-1,3,4,4a,8,8a-hexahydroisoquinoline-5,7,7-tricarbonitrile

Systemtic Name: 6-azanyl-8-(4-methoxyphenyl)-2-methyl-1,3,4,4a,8,8a-hexahydroisoquinoline-5,7,7-tricarbonitrile Openeye Name: 6-amino-8-(4-methoxyphenyl)-2-methyl-1,3,4,4a,8,8a-hexahydroisoquinoline-5,7,7-tricarbonitrile CAS Name: 6-amino-8-(4-methoxyphenyl)-2-methyl-1,3,4,4a,8,8a-hexahydroisoquinoline-5,7,7-tricarbonitrile IUPAC Name: 6-amino-8-(4-methoxyphenyl)-2-methyl-1,3,4,4a,8,8a-hexahydroisoquinoline-5,7,7-tricarbonitrile Traditional Name: 6-amino-8-(4-methoxyphenyl)-2-methyl-1,3,4,4a,8,8a-hexahydroisoquinoline-5,7,7-tricarbonitrile Formula: C20H21N5O MolecularWeight: 347.41364

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2C(C1)C(C(C(=C2C#N)N)(C#N)C#N)C3=CC=C(C=C3)OC

Isomeric SMILES

CN1CCC2C(C1)C(C(C(=C2C#N)N)(C#N)C#N)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H21N5O/c1-25-8-7-15-16(9-21)19(24)20(11-22,12-23)18(17(15)10-25)13-3-5-14(26-2)6-4-13/h3-6,15,17-18H,7-8,10,24H2,1-2H3