butan-2-yl 2-azanyl-1-hexyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: butan-2-yl 2-azanyl-1-hexyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: sec-butyl 2-amino-1-hexyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-hexyl-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid butan-2-yl ester IUPAC Name: butan-2-yl 2-amino-1-hexylpyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-hexyl-pyrrolo[3,2-b]quinoxaline-3-carboxylic acid sec-butyl ester Formula: C21H28N4O2 MolecularWeight: 368.47262

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N4O2/c1-4-6-7-10-13-25-19(22)17(21(26)27-14(3)5-2)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