tert-butyl 3-[4-(1,4-benzodioxin-3-yl)-1-methyl-2,5-bis(oxidanylidene)pyrrol-3-yl]-5-phenylmethoxy-indole-1-carboxylate

Systemtic Name: tert-butyl 3-[4-(1,4-benzodioxin-3-yl)-1-methyl-2,5-bis(oxidanylidene)pyrrol-3-yl]-5-phenylmethoxy-indole-1-carboxylate Openeye Name: tert-butyl 3-[4-(1,4-benzodioxin-3-yl)-1-methyl-2,5-dioxo-pyrrol-3-yl]-5-benzyloxy-indole-1-carboxylate CAS Name: 3-[4-(1,4-benzodioxin-3-yl)-1-methyl-2,5-dioxo-3-pyrrolyl]-5-phenylmethoxy-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[4-(1,4-benzodioxin-3-yl)-1-methyl-2,5-dioxopyrrol-3-yl]-5-phenylmethoxyindole-1-carboxylate Traditional Name: 3-[4-(1,4-benzodioxin-3-yl)-2,5-diketo-1-methyl-3-pyrrolin-3-yl]-5-benzoxy-indole-1-carboxylic acid tert-butyl ester Formula: C33H28N2O7 MolecularWeight: 564.58462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=C1C=CC(=C2)OCC3=CC=CC=C3)C4=C(C(=O)N(C4=O)C)C5=COC6=CC=CC=C6O5

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=C1C=CC(=C2)OCC3=CC=CC=C3)C4=C(C(=O)N(C4=O)C)C5=COC6=CC=CC=C6O5

InChI

InChI=1S/C33H28N2O7/c1-33(2,3)42-32(38)35-17-23(22-16-21(14-15-24(22)35)39-18-20-10-6-5-7-11-20)28-29(31(37)34(4)30(28)36)27-19-40-25-12-8-9-13-26(25)41-27/h5-17,19H,18H2,1-4H3