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

Systemtic Name: hexyl 2-azanyl-1-(3-bromophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: hexyl 2-amino-1-(3-bromophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-(3-bromophenyl)-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid hexyl ester IUPAC Name: hexyl 2-amino-1-(3-bromophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-(3-bromophenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylic acid hexyl ester Formula: C23H23BrN4O2 MolecularWeight: 467.35832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23BrN4O2/c1-2-3-4-7-13-30-23(29)19-20-22(27-18-12-6-5-11-17(18)26-20)28(21(19)25)16-10-8-9-15(24)14-16/h5-6,8-12,14H,2-4,7,13,25H2,1H3