ethyl 2-azanyl-1-(2-ethylhexyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: ethyl 2-azanyl-1-(2-ethylhexyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: ethyl 2-amino-1-(2-ethylhexyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-(2-ethylhexyl)-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-1-(2-ethylhexyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-(2-ethylhexyl)pyrrolo[3,2-b]quinoxaline-3-carboxylic acid ethyl ester Formula: C21H28N4O2 MolecularWeight: 368.47262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OCC)N

Isomeric SMILES

CCCCC(CC)CN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OCC)N

InChI

InChI=1S/C21H28N4O2/c1-4-7-10-14(5-2)13-25-19(22)17(21(26)27-6-3)18-20(25)24-16-12-9-8-11-15(16)23-18/h8-9,11-12,14H,4-7,10,13,22H2,1-3H3