N-(2,5-dimethoxyphenyl)-1-[(2-methoxyphenyl)amino]isoquinoline-4-carboxamide

Systemtic Name: N-(2,5-dimethoxyphenyl)-1-[(2-methoxyphenyl)amino]isoquinoline-4-carboxamide Openeye Name: N-(2,5-dimethoxyphenyl)-1-(2-methoxyanilino)isoquinoline-4-carboxamide CAS Name: N-(2,5-dimethoxyphenyl)-1-(2-methoxyanilino)-4-isoquinolinecarboxamide IUPAC Name: N-(2,5-dimethoxyphenyl)-1-(2-methoxyanilino)isoquinoline-4-carboxamide Traditional Name: N-(2,5-dimethoxyphenyl)-1-(o-anisidino)isoquinoline-4-carboxamide Formula: C25H23N3O4 MolecularWeight: 429.46782

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=O)C2=CN=C(C3=CC=CC=C32)NC4=CC=CC=C4OC

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=O)C2=CN=C(C3=CC=CC=C32)NC4=CC=CC=C4OC

InChI

InChI=1S/C25H23N3O4/c1-30-16-12-13-23(32-3)21(14-16)28-25(29)19-15-26-24(18-9-5-4-8-17(18)19)27-20-10-6-7-11-22(20)31-2/h4-15H,1-3H3,(H,26,27)(H,28,29)