methyl 4-[2-(dioxidanyl)-3-methyl-but-3-enyl]-1-methoxy-9H-carbazole-3-carboxylate

Systemtic Name: methyl 4-[2-(dioxidanyl)-3-methyl-but-3-enyl]-1-methoxy-9H-carbazole-3-carboxylate Openeye Name: methyl 4-(2-hydroperoxy-3-methyl-but-3-enyl)-1-methoxy-9H-carbazole-3-carboxylate CAS Name: 4-(2-hydroperoxy-3-methylbut-3-enyl)-1-methoxy-9H-carbazole-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(2-hydroperoxy-3-methylbut-3-enyl)-1-methoxy-9H-carbazole-3-carboxylate Traditional Name: 4-(2-hydroperoxy-3-methyl-but-3-enyl)-1-methoxy-9H-carbazole-3-carboxylic acid methyl ester Formula: C20H21NO5 MolecularWeight: 355.38444

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(CC1=C2C3=CC=CC=C3NC2=C(C=C1C(=O)OC)OC)OO

Isomeric SMILES

CC(=C)C(CC1=C2C3=CC=CC=C3NC2=C(C=C1C(=O)OC)OC)OO

InChI

InChI=1S/C20H21NO5/c1-11(2)16(26-23)9-13-14(20(22)25-4)10-17(24-3)19-18(13)12-7-5-6-8-15(12)21-19/h5-8,10,16,21,23H,1,9H2,2-4H3