hexyl 2-azanyl-1-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: hexyl 2-azanyl-1-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: hexyl 2-amino-1-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-phenethyl-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid hexyl ester IUPAC Name: hexyl 2-amino-1-phenethylpyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxylic acid hexyl ester Formula: C25H28N4O2 MolecularWeight: 416.51542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CCC4=CC=CC=C4)N

Isomeric SMILES

CCCCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CCC4=CC=CC=C4)N

InChI

InChI=1S/C25H28N4O2/c1-2-3-4-10-17-31-25(30)21-22-24(28-20-14-9-8-13-19(20)27-22)29(23(21)26)16-15-18-11-6-5-7-12-18/h5-9,11-14H,2-4,10,15-17,26H2,1H3