butan-2-yl 2-azanyl-1-(3-fluoranyl-4-methyl-phenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: butan-2-yl 2-azanyl-1-(3-fluoranyl-4-methyl-phenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: sec-butyl 2-amino-1-(3-fluoro-4-methyl-phenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-(3-fluoro-4-methylphenyl)-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid butan-2-yl ester IUPAC Name: butan-2-yl 2-amino-1-(3-fluoro-4-methylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-(3-fluoro-4-methyl-phenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylic acid sec-butyl ester Formula: C22H21FN4O2 MolecularWeight: 392.426143

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC(=C(C=C4)C)F)N

Isomeric SMILES

CCC(C)OC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC(=C(C=C4)C)F)N

InChI

InChI=1S/C22H21FN4O2/c1-4-13(3)29-22(28)18-19-21(26-17-8-6-5-7-16(17)25-19)27(20(18)24)14-10-9-12(2)15(23)11-14/h5-11,13H,4,24H2,1-3H3