tert-butyl 1,3-bis(oxidanylidene)-4-(2-oxidanylphenoxy)-8-phenylmethoxy-pyrrolo[3,4-c]carbazole-6-carboxylate

Systemtic Name: tert-butyl 1,3-bis(oxidanylidene)-4-(2-oxidanylphenoxy)-8-phenylmethoxy-pyrrolo[3,4-c]carbazole-6-carboxylate Openeye Name: tert-butyl 8-benzyloxy-4-(2-hydroxyphenoxy)-1,3-dioxo-pyrrolo[3,4-c]carbazole-6-carboxylate CAS Name: 4-(2-hydroxyphenoxy)-1,3-dioxo-8-phenylmethoxy-6-pyrrolo[3,4-c]carbazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-hydroxyphenoxy)-1,3-dioxo-8-phenylmethoxypyrrolo[3,4-c]carbazole-6-carboxylate Traditional Name: 8-benzoxy-4-(2-hydroxyphenoxy)-1,3-diketo-pyrrolo[3,4-c]carbazole-6-carboxylic acid tert-butyl ester Formula: C32H26N2O7 MolecularWeight: 550.55804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2=CC(=C3C(=C2C4=C1C=C(C=C4)OCC5=CC=CC=C5)C(=O)NC3=O)OC6=CC=CC=C6O

Isomeric SMILES

CC(C)(C)OC(=O)N1C2=CC(=C3C(=C2C4=C1C=C(C=C4)OCC5=CC=CC=C5)C(=O)NC3=O)OC6=CC=CC=C6O

InChI

InChI=1S/C32H26N2O7/c1-32(2,3)41-31(38)34-21-15-19(39-17-18-9-5-4-6-10-18)13-14-20(21)26-22(34)16-25(27-28(26)30(37)33-29(27)36)40-24-12-8-7-11-23(24)35/h4-16,35H,17H2,1-3H3,(H,33,36,37)