2-methylbutyl 2-azanyl-1-pentyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: 2-methylbutyl 2-azanyl-1-pentyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: 2-methylbutyl 2-amino-1-pentyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-pentyl-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid 2-methylbutyl ester IUPAC Name: 2-methylbutyl 2-amino-1-pentylpyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-amyl-pyrrolo[3,2-b]quinoxaline-3-carboxylic acid 2-methylbutyl ester Formula: C21H28N4O2 MolecularWeight: 368.47262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OCC(C)CC)N

Isomeric SMILES

CCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OCC(C)CC)N

InChI

InChI=1S/C21H28N4O2/c1-4-6-9-12-25-19(22)17(21(26)27-13-14(3)5-2)18-20(25)24-16-11-8-7-10-15(16)23-18/h7-8,10-11,14H,4-6,9,12-13,22H2,1-3H3