4-[[1-(dimethylamino)cyclohexyl]methyliminomethyl]-2-(4-methoxyphenyl)-4H-isoquinoline-1,3-dione

Systemtic Name: 4-[[1-(dimethylamino)cyclohexyl]methyliminomethyl]-2-(4-methoxyphenyl)-4H-isoquinoline-1,3-dione Openeye Name: 4-[[1-(dimethylamino)cyclohexyl]methyliminomethyl]-2-(4-methoxyphenyl)-4H-isoquinoline-1,3-dione CAS Name: 4-[[1-(dimethylamino)cyclohexyl]methyliminomethyl]-2-(4-methoxyphenyl)-4H-isoquinoline-1,3-dione IUPAC Name: 4-[[1-(dimethylamino)cyclohexyl]methyliminomethyl]-2-(4-methoxyphenyl)-4H-isoquinoline-1,3-dione Traditional Name: 4-[[1-(dimethylamino)cyclohexyl]methyliminomethyl]-2-(4-methoxyphenyl)-4H-isoquinoline-1,3-quinone Formula: C26H31N3O3 MolecularWeight: 433.54264

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1(CCCCC1)CN=CC2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CN(C)C1(CCCCC1)CN=CC2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C26H31N3O3/c1-28(2)26(15-7-4-8-16-26)18-27-17-23-21-9-5-6-10-22(21)24(30)29(25(23)31)19-11-13-20(32-3)14-12-19/h5-6,9-14,17,23H,4,7-8,15-16,18H2,1-3H3