ethyl 2-azanyl-1-octan-3-yl-pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: ethyl 2-azanyl-1-octan-3-yl-pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: ethyl 2-amino-1-(1-ethylhexyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-octan-3-yl-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-1-octan-3-ylpyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-(1-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:

CCCCCC(CC)N1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OCC)N

Isomeric SMILES

CCCCCC(CC)N1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OCC)N

InChI

InChI=1S/C21H28N4O2/c1-4-7-8-11-14(5-2)25-19(22)17(21(26)27-6-3)18-20(25)24-16-13-10-9-12-15(16)23-18/h9-10,12-14H,4-8,11,22H2,1-3H3