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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CN=C(C4=CC=CC=C43)NC5=CC=CC=C5OC

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CN=C(C4=CC=CC=C43)NC5=CC=CC=C5OC

InChI

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