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

Systemtic Name: oxolan-2-ylmethyl 2-azanyl-1-hexyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: tetrahydrofuran-2-ylmethyl 2-amino-1-hexyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-hexyl-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid 2-oxolanylmethyl ester IUPAC Name: oxolan-2-ylmethyl 2-amino-1-hexylpyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-hexyl-pyrrolo[3,2-b]quinoxaline-3-carboxylic acid tetrahydrofurfuryl ester Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OCC4CCCO4)N

Isomeric SMILES

CCCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OCC4CCCO4)N

InChI

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