2-[[3,7-dimethoxy-6-(2-methoxyethoxymethoxymethyl)-10-methyl-phenothiazin-4-yl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[3,7-dimethoxy-6-(2-methoxyethoxymethoxymethyl)-10-methyl-phenothiazin-4-yl]methyl]isoindole-1,3-dione Openeye Name: 2-[[3,7-dimethoxy-6-(2-methoxyethoxymethoxymethyl)-10-methyl-phenothiazin-4-yl]methyl]isoindoline-1,3-dione CAS Name: 2-[[3,7-dimethoxy-6-(2-methoxyethoxymethoxymethyl)-10-methyl-4-phenothiazinyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[3,7-dimethoxy-6-(2-methoxyethoxymethoxymethyl)-10-methylphenothiazin-4-yl]methyl]isoindole-1,3-dione Traditional Name: 2-[[3,7-dimethoxy-6-(2-methoxyethoxymethoxymethyl)-10-methyl-phenothiazin-4-yl]methyl]isoindoline-1,3-quinone Formula: C29H30N2O7S MolecularWeight: 550.6227

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=C(C=C2)OC)CN3C(=O)C4=CC=CC=C4C3=O)SC5=C1C=CC(=C5COCOCCOC)OC

Isomeric SMILES

CN1C2=C(C(=C(C=C2)OC)CN3C(=O)C4=CC=CC=C4C3=O)SC5=C1C=CC(=C5COCOCCOC)OC

InChI

InChI=1S/C29H30N2O7S/c1-30-22-9-11-24(35-3)20(15-31-28(32)18-7-5-6-8-19(18)29(31)33)26(22)39-27-21(16-38-17-37-14-13-34-2)25(36-4)12-10-23(27)30/h5-12H,13-17H2,1-4H3