2-azanyl-1-dodecyl-pyrrolo[3,2-b]quinoxaline-3-carbonitrile

Systemtic Name: 2-azanyl-1-dodecyl-pyrrolo[3,2-b]quinoxaline-3-carbonitrile Openeye Name: 2-amino-1-dodecyl-pyrrolo[3,2-b]quinoxaline-3-carbonitrile CAS Name: 2-amino-1-dodecyl-3-pyrrolo[3,2-b]quinoxalinecarbonitrile IUPAC Name: 2-amino-1-dodecylpyrrolo[3,2-b]quinoxaline-3-carbonitrile Traditional Name: 2-amino-1-lauryl-pyrrolo[3,2-b]quinoxaline-3-carbonitrile Formula: C23H31N5 MolecularWeight: 377.52574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C#N)N

Isomeric SMILES

CCCCCCCCCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C#N)N

InChI

InChI=1S/C23H31N5/c1-2-3-4-5-6-7-8-9-10-13-16-28-22(25)18(17-24)21-23(28)27-20-15-12-11-14-19(20)26-21/h11-12,14-15H,2-10,13,16,25H2,1H3