3-[2-(4-isoquinolin-1-ylpiperazin-1-yl)-2-oxidanylidene-ethanoyl]-4-methoxy-1H-indole-7-carboxamide

Systemtic Name: 3-[2-(4-isoquinolin-1-ylpiperazin-1-yl)-2-oxidanylidene-ethanoyl]-4-methoxy-1H-indole-7-carboxamide Openeye Name: 3-[2-[4-(1-isoquinolyl)piperazin-1-yl]-2-oxo-acetyl]-4-methoxy-1H-indole-7-carboxamide CAS Name: 3-[2-[4-(1-isoquinolinyl)-1-piperazinyl]-1,2-dioxoethyl]-4-methoxy-1H-indole-7-carboxamide IUPAC Name: 3-[2-(4-isoquinolin-1-ylpiperazin-1-yl)-2-oxoacetyl]-4-methoxy-1H-indole-7-carboxamide Traditional Name: 3-[2-[4-(1-isoquinolyl)piperazino]-2-keto-acetyl]-4-methoxy-1H-indole-7-carboxamide Formula: C25H23N5O4 MolecularWeight: 457.48122

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CNC2=C(C=C1)C(=O)N)C(=O)C(=O)N3CCN(CC3)C4=NC=CC5=CC=CC=C54

Isomeric SMILES

COC1=C2C(=CNC2=C(C=C1)C(=O)N)C(=O)C(=O)N3CCN(CC3)C4=NC=CC5=CC=CC=C54

InChI

InChI=1S/C25H23N5O4/c1-34-19-7-6-17(23(26)32)21-20(19)18(14-28-21)22(31)25(33)30-12-10-29(11-13-30)24-16-5-3-2-4-15(16)8-9-27-24/h2-9,14,28H,10-13H2,1H3,(H2,26,32)