hexyl 2-azanyl-1-(4-ethanoylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: hexyl 2-azanyl-1-(4-ethanoylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: hexyl 1-(4-acetylphenyl)-2-amino-pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 1-(4-acetylphenyl)-2-amino-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid hexyl ester IUPAC Name: hexyl 1-(4-acetylphenyl)-2-aminopyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 1-(4-acetylphenyl)-2-amino-pyrrolo[3,2-b]quinoxaline-3-carboxylic acid hexyl ester Formula: C25H26N4O3 MolecularWeight: 430.49894

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26N4O3/c1-3-4-5-8-15-32-25(31)21-22-24(28-20-10-7-6-9-19(20)27-22)29(23(21)26)18-13-11-17(12-14-18)16(2)30/h6-7,9-14H,3-5,8,15,26H2,1-2H3