trimethyl 4-(5-azanyl-4-cyano-3-methyl-pyrazol-1-yl)-8-chloranyl-pyrrolo[1,2-a]quinoxaline-1,2,3-tricarboxylate

Systemtic Name: trimethyl 4-(5-azanyl-4-cyano-3-methyl-pyrazol-1-yl)-8-chloranyl-pyrrolo[1,2-a]quinoxaline-1,2,3-tricarboxylate Openeye Name: trimethyl 4-(5-amino-4-cyano-3-methyl-pyrazol-1-yl)-8-chloro-pyrrolo[1,2-a]quinoxaline-1,2,3-tricarboxylate CAS Name: 4-(5-amino-4-cyano-3-methyl-1-pyrazolyl)-8-chloropyrrolo[1,2-a]quinoxaline-1,2,3-tricarboxylic acid trimethyl ester IUPAC Name: trimethyl 4-(5-amino-4-cyano-3-methylpyrazol-1-yl)-8-chloropyrrolo[1,2-a]quinoxaline-1,2,3-tricarboxylate Traditional Name: 4-(5-amino-4-cyano-3-methyl-pyrazol-1-yl)-8-chloro-pyrrolo[1,2-a]quinoxaline-1,2,3-tricarboxylic acid trimethyl ester Formula: C22H17ClN6O6 MolecularWeight: 496.85998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C#N)N)C2=NC3=C(C=C(C=C3)Cl)N4C2=C(C(=C4C(=O)OC)C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=NN(C(=C1C#N)N)C2=NC3=C(C=C(C=C3)Cl)N4C2=C(C(=C4C(=O)OC)C(=O)OC)C(=O)OC

InChI

InChI=1S/C22H17ClN6O6/c1-9-11(8-24)18(25)29(27-9)19-16-14(20(30)33-2)15(21(31)34-3)17(22(32)35-4)28(16)13-7-10(23)5-6-12(13)26-19/h5-7H,25H2,1-4H3