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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OC4CCCCC4)N

Isomeric SMILES

CC(C)CCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OC4CCCCC4)N

InChI

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