2-[[2-(8-methoxy-5H-pyrimido[5,4-b]indol-4-yl)-3,4-dihydro-1H-isoquinolin-1-yl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[2-(8-methoxy-5H-pyrimido[5,4-b]indol-4-yl)-3,4-dihydro-1H-isoquinolin-1-yl]methyl]isoindole-1,3-dione Openeye Name: 2-[[2-(8-methoxy-5H-pyrimido[5,4-b]indol-4-yl)-3,4-dihydro-1H-isoquinolin-1-yl]methyl]isoindoline-1,3-dione CAS Name: 2-[[2-(8-methoxy-5H-pyrimido[5,4-b]indol-4-yl)-3,4-dihydro-1H-isoquinolin-1-yl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[2-(8-methoxy-5H-pyrimido[5,4-b]indol-4-yl)-3,4-dihydro-1H-isoquinolin-1-yl]methyl]isoindole-1,3-dione Traditional Name: 2-[[2-(8-methoxy-5H-pyrimid[5,4-b]indol-4-yl)-3,4-dihydro-1H-isoquinolin-1-yl]methyl]isoindoline-1,3-quinone Formula: C29H23N5O3 MolecularWeight: 489.52462

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC3=C2N=CN=C3N4CCC5=CC=CC=C5C4CN6C(=O)C7=CC=CC=C7C6=O

Isomeric SMILES

COC1=CC2=C(C=C1)NC3=C2N=CN=C3N4CCC5=CC=CC=C5C4CN6C(=O)C7=CC=CC=C7C6=O

InChI

InChI=1S/C29H23N5O3/c1-37-18-10-11-23-22(14-18)25-26(32-23)27(31-16-30-25)33-13-12-17-6-2-3-7-19(17)24(33)15-34-28(35)20-8-4-5-9-21(20)29(34)36/h2-11,14,16,24,32H,12-13,15H2,1H3