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

Systemtic Name: 3-methylbutyl 2-azanyl-1-cyclohexyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: isopentyl 2-amino-1-cyclohexyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-cyclohexyl-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 2-amino-1-cyclohexylpyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-cyclohexyl-pyrrolo[3,2-b]quinoxaline-3-carboxylic acid isoamyl ester Formula: C22H28N4O2 MolecularWeight: 380.48332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4CCCCC4)N

Isomeric SMILES

CC(C)CCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4CCCCC4)N

InChI

InChI=1S/C22H28N4O2/c1-14(2)12-13-28-22(27)18-19-21(25-17-11-7-6-10-16(17)24-19)26(20(18)23)15-8-4-3-5-9-15/h6-7,10-11,14-15H,3-5,8-9,12-13,23H2,1-2H3