6-azanyl-8-(2-chloranyl-5-methoxy-4-propoxy-phenyl)-2-methyl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile

Systemtic Name: 6-azanyl-8-(2-chloranyl-5-methoxy-4-propoxy-phenyl)-2-methyl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile Openeye Name: 6-amino-8-(2-chloro-5-methoxy-4-propoxy-phenyl)-2-methyl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile CAS Name: 6-amino-8-(2-chloro-5-methoxy-4-propoxyphenyl)-2-methyl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile IUPAC Name: 6-amino-8-(2-chloro-5-methoxy-4-propoxyphenyl)-2-methyl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile Traditional Name: 6-amino-8-(2-chloro-5-methoxy-4-propoxy-phenyl)-2-methyl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile Formula: C23H24ClN5O2 MolecularWeight: 437.92196

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C(=C1)Cl)C2C3CN(CC=C3C(=C(C2(C#N)C#N)N)C#N)C)OC

Isomeric SMILES

CCCOC1=C(C=C(C(=C1)Cl)C2C3CN(CC=C3C(=C(C2(C#N)C#N)N)C#N)C)OC

InChI

InChI=1S/C23H24ClN5O2/c1-4-7-31-20-9-18(24)15(8-19(20)30-3)21-17-11-29(2)6-5-14(17)16(10-25)22(28)23(21,12-26)13-27/h5,8-9,17,21H,4,6-7,11,28H2,1-3H3