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

Systemtic Name: cyclohexyl 2-azanyl-1-(2-methylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: cyclohexyl 2-amino-1-isobutyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-(2-methylpropyl)-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-amino-1-(2-methylpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-isobutyl-pyrrolo[3,2-b]quinoxaline-3-carboxylic acid cyclohexyl ester Formula: C21H26N4O2 MolecularWeight: 366.45674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OC4CCCCC4)N

Isomeric SMILES

CC(C)CN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OC4CCCCC4)N

InChI

InChI=1S/C21H26N4O2/c1-13(2)12-25-19(22)17(21(26)27-14-8-4-3-5-9-14)18-20(25)24-16-11-7-6-10-15(16)23-18/h6-7,10-11,13-14H,3-5,8-9,12,22H2,1-2H3