hexyl 2-azanyl-1-[[(2R)-oxolan-2-yl]methyl]pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: hexyl 2-azanyl-1-[[(2R)-oxolan-2-yl]methyl]pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: hexyl 2-amino-1-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-[[(2R)-2-oxolanyl]methyl]-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid hexyl ester IUPAC Name: hexyl 2-amino-1-[[(2R)-oxolan-2-yl]methyl]pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrrolo[3,2-b]quinoxaline-3-carboxylic acid hexyl ester Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC4CCCO4)N

Isomeric SMILES

CCCCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C[C@H]4CCCO4)N

InChI

InChI=1S/C22H28N4O3/c1-2-3-4-7-12-29-22(27)18-19-21(25-17-11-6-5-10-16(17)24-19)26(20(18)23)14-15-9-8-13-28-15/h5-6,10-11,15H,2-4,7-9,12-14,23H2,1H3/t15-/m1/s1