ethyl 2-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethanoylamino]-1-hexyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: ethyl 2-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethanoylamino]-1-hexyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: ethyl 2-[[2-(1,3-dioxoisoindolin-2-yl)acetyl]amino]-1-hexyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-[[2-(1,3-dioxo-2-isoindolyl)-1-oxoethyl]amino]-1-hexyl-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(1,3-dioxoisoindol-2-yl)acetyl]amino]-1-hexylpyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 1-hexyl-2-[(2-phthalimidoacetyl)amino]pyrrolo[3,2-b]quinoxaline-3-carboxylic acid ethyl ester Formula: C29H29N5O5 MolecularWeight: 527.57106

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OCC)NC(=O)CN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CCCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OCC)NC(=O)CN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C29H29N5O5/c1-3-5-6-11-16-33-25(32-22(35)17-34-27(36)18-12-7-8-13-19(18)28(34)37)23(29(38)39-4-2)24-26(33)31-21-15-10-9-14-20(21)30-24/h7-10,12-15H,3-6,11,16-17H2,1-2H3,(H,32,35)