1-(4-isoquinolin-1-ylpiperazin-1-yl)-2-(4-methoxy-7-pyrrol-1-yl-1H-indol-3-yl)ethane-1,2-dione

Systemtic Name: 1-(4-isoquinolin-1-ylpiperazin-1-yl)-2-(4-methoxy-7-pyrrol-1-yl-1H-indol-3-yl)ethane-1,2-dione Openeye Name: 1-[4-(1-isoquinolyl)piperazin-1-yl]-2-(4-methoxy-7-pyrrol-1-yl-1H-indol-3-yl)ethane-1,2-dione CAS Name: 1-[4-(1-isoquinolinyl)-1-piperazinyl]-2-[4-methoxy-7-(1-pyrrolyl)-1H-indol-3-yl]ethane-1,2-dione IUPAC Name: 1-(4-isoquinolin-1-ylpiperazin-1-yl)-2-(4-methoxy-7-pyrrol-1-yl-1H-indol-3-yl)ethane-1,2-dione Traditional Name: 1-[4-(1-isoquinolyl)piperazino]-2-(4-methoxy-7-pyrrol-1-yl-1H-indol-3-yl)ethane-1,2-dione Formula: C28H25N5O3 MolecularWeight: 479.5298

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CNC2=C(C=C1)N3C=CC=C3)C(=O)C(=O)N4CCN(CC4)C5=NC=CC6=CC=CC=C65

Isomeric SMILES

COC1=C2C(=CNC2=C(C=C1)N3C=CC=C3)C(=O)C(=O)N4CCN(CC4)C5=NC=CC6=CC=CC=C65

InChI

InChI=1S/C28H25N5O3/c1-36-23-9-8-22(31-12-4-5-13-31)25-24(23)21(18-30-25)26(34)28(35)33-16-14-32(15-17-33)27-20-7-3-2-6-19(20)10-11-29-27/h2-13,18,30H,14-17H2,1H3