(4-tert-butylphenyl) 2,3-bis(1H-pyrrol-2-yl)quinoxaline-6-carboxylate

Systemtic Name: (4-tert-butylphenyl) 2,3-bis(1H-pyrrol-2-yl)quinoxaline-6-carboxylate Openeye Name: (4-tert-butylphenyl) 2,3-bis(1H-pyrrol-2-yl)quinoxaline-6-carboxylate CAS Name: 2,3-bis(1H-pyrrol-2-yl)-6-quinoxalinecarboxylic acid (4-tert-butylphenyl) ester IUPAC Name: (4-tert-butylphenyl) 2,3-bis(1H-pyrrol-2-yl)quinoxaline-6-carboxylate Traditional Name: 2,3-bis(1H-pyrrol-2-yl)quinoxaline-6-carboxylic acid (4-tert-butylphenyl) ester Formula: C27H24N4O2 MolecularWeight: 436.50506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OC(=O)C2=CC3=C(C=C2)N=C(C(=N3)C4=CC=CN4)C5=CC=CN5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OC(=O)C2=CC3=C(C=C2)N=C(C(=N3)C4=CC=CN4)C5=CC=CN5

InChI

InChI=1S/C27H24N4O2/c1-27(2,3)18-9-11-19(12-10-18)33-26(32)17-8-13-20-23(16-17)31-25(22-7-5-15-29-22)24(30-20)21-6-4-14-28-21/h4-16,28-29H,1-3H3