2-azanyl-1-(4-octoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carbonitrile

Systemtic Name: 2-azanyl-1-(4-octoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carbonitrile Openeye Name: 2-amino-1-(4-octoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carbonitrile CAS Name: 2-amino-1-(4-octoxyphenyl)-3-pyrrolo[3,2-b]quinoxalinecarbonitrile IUPAC Name: 2-amino-1-(4-octoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carbonitrile Traditional Name: 2-amino-1-(4-octoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carbonitrile Formula: C25H27N5O MolecularWeight: 413.51478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C#N)N

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C#N)N

InChI

InChI=1S/C25H27N5O/c1-2-3-4-5-6-9-16-31-19-14-12-18(13-15-19)30-24(27)20(17-26)23-25(30)29-22-11-8-7-10-21(22)28-23/h7-8,10-15H,2-6,9,16,27H2,1H3