2-azanyl-1-(4-morpholin-4-ylphenyl)-N-octyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-1-(4-morpholin-4-ylphenyl)-N-octyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-(4-morpholinophenyl)-N-octyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-[4-(4-morpholinyl)phenyl]-N-octyl-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-(4-morpholin-4-ylphenyl)-N-octylpyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-(4-morpholinophenyl)-N-octyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C29H36N6O2 MolecularWeight: 500.63514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=C(C=C4)N5CCOCC5)N

Isomeric SMILES

CCCCCCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=C(C=C4)N5CCOCC5)N

InChI

InChI=1S/C29H36N6O2/c1-2-3-4-5-6-9-16-31-29(36)25-26-28(33-24-11-8-7-10-23(24)32-26)35(27(25)30)22-14-12-21(13-15-22)34-17-19-37-20-18-34/h7-8,10-15H,2-6,9,16-20,30H2,1H3,(H,31,36)