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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C2=CN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)OC

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)C2=CN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)OC

InChI

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