N-(4-ethoxyphenyl)-1-[(2-methoxyphenyl)amino]isoquinoline-4-carboxamide

Systemtic Name: N-(4-ethoxyphenyl)-1-[(2-methoxyphenyl)amino]isoquinoline-4-carboxamide Openeye Name: N-(4-ethoxyphenyl)-1-(2-methoxyanilino)isoquinoline-4-carboxamide CAS Name: N-(4-ethoxyphenyl)-1-(2-methoxyanilino)-4-isoquinolinecarboxamide IUPAC Name: N-(4-ethoxyphenyl)-1-(2-methoxyanilino)isoquinoline-4-carboxamide Traditional Name: 1-(o-anisidino)-N-p-phenetyl-isoquinoline-4-carboxamide Formula: C25H23N3O3 MolecularWeight: 413.46842

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=CN=C(C3=CC=CC=C32)NC4=CC=CC=C4OC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=CN=C(C3=CC=CC=C32)NC4=CC=CC=C4OC

InChI

InChI=1S/C25H23N3O3/c1-3-31-18-14-12-17(13-15-18)27-25(29)21-16-26-24(20-9-5-4-8-19(20)21)28-22-10-6-7-11-23(22)30-2/h4-16H,3H2,1-2H3,(H,26,28)(H,27,29)