4-isoquinolin-1-yl-N-(4-phenoxyphenyl)piperazine-1-carboxamide

Systemtic Name: 4-isoquinolin-1-yl-N-(4-phenoxyphenyl)piperazine-1-carboxamide Openeye Name: 4-(1-isoquinolyl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide CAS Name: 4-(1-isoquinolinyl)-N-(4-phenoxyphenyl)-1-piperazinecarboxamide IUPAC Name: 4-isoquinolin-1-yl-N-(4-phenoxyphenyl)piperazine-1-carboxamide Traditional Name: 4-(1-isoquinolyl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide Formula: C26H24N4O2 MolecularWeight: 424.49436

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC3=CC=CC=C32)C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=NC=CC3=CC=CC=C32)C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C26H24N4O2/c31-26(28-21-10-12-23(13-11-21)32-22-7-2-1-3-8-22)30-18-16-29(17-19-30)25-24-9-5-4-6-20(24)14-15-27-25/h1-15H,16-19H2,(H,28,31)