[1-[(4-methoxyphenyl)amino]isoquinolin-4-yl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone

Systemtic Name: [1-[(4-methoxyphenyl)amino]isoquinolin-4-yl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone Openeye Name: [1-(4-methoxyanilino)-4-isoquinolyl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone CAS Name: [1-(4-methoxyanilino)-4-isoquinolinyl]-[4-(2-methoxyphenyl)-1-piperazinyl]methanone IUPAC Name: [1-(4-methoxyanilino)isoquinolin-4-yl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone Traditional Name: [4-(2-methoxyphenyl)piperazino]-[1-(p-anisidino)-4-isoquinolyl]methanone Formula: C28H28N4O3 MolecularWeight: 468.54692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NC=C(C3=CC=CC=C32)C(=O)N4CCN(CC4)C5=CC=CC=C5OC

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NC=C(C3=CC=CC=C32)C(=O)N4CCN(CC4)C5=CC=CC=C5OC

InChI

InChI=1S/C28H28N4O3/c1-34-21-13-11-20(12-14-21)30-27-23-8-4-3-7-22(23)24(19-29-27)28(33)32-17-15-31(16-18-32)25-9-5-6-10-26(25)35-2/h3-14,19H,15-18H2,1-2H3,(H,29,30)