butanoic acid; tert-butyl 7-chloranyl-5-pyrrolidin-1-ylcarbonyl-4H-imidazo[1,5-a]quinoxaline-3-carboxylate

Systemtic Name: butanoic acid; tert-butyl 7-chloranyl-5-pyrrolidin-1-ylcarbonyl-4H-imidazo[1,5-a]quinoxaline-3-carboxylate Openeye Name: tert-butyl 7-chloro-5-(pyrrolidine-1-carbonyl)-4H-imidazo[1,5-a]quinoxaline-3-carboxylate; butyric acid CAS Name: butanoic acid; 7-chloro-5-[oxo(1-pyrrolidinyl)methyl]-4H-imidazo[1,5-a]quinoxaline-3-carboxylic acid tert-butyl ester IUPAC Name: butanoic acid; tert-butyl 7-chloro-5-(pyrrolidine-1-carbonyl)-4H-imidazo[1,5-a]quinoxaline-3-carboxylate Traditional Name: butyric acid; 7-chloro-5-(pyrrolidine-1-carbonyl)-4H-imidazo[1,5-a]quinoxaline-3-carboxylic acid tert-butyl ester Formula: C24H31ClN4O5 MolecularWeight: 490.97974

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)O.CC(C)(C)OC(=O)C1=C2CN(C3=C(N2C=N1)C=CC(=C3)Cl)C(=O)N4CCCC4

Isomeric SMILES

CCCC(=O)O.CC(C)(C)OC(=O)C1=C2CN(C3=C(N2C=N1)C=CC(=C3)Cl)C(=O)N4CCCC4

InChI

InChI=1S/C20H23ClN4O3.C4H8O2/c1-20(2,3)28-18(26)17-16-11-24(19(27)23-8-4-5-9-23)15-10-13(21)6-7-14(15)25(16)12-22-17;1-2-3-4(5)6/h6-7,10,12H,4-5,8-9,11H2,1-3H3;2-3H2,1H3,(H,5,6)