3-bromanyl-1-methyl-4-[5-methyl-1-[(2-methylpropan-2-yl)oxy-oxidanyl-methyl]indol-3-yl]pyrrole-2,5-dione

Systemtic Name: 3-bromanyl-1-methyl-4-[5-methyl-1-[(2-methylpropan-2-yl)oxy-oxidanyl-methyl]indol-3-yl]pyrrole-2,5-dione Openeye Name: 3-bromo-4-[1-[tert-butoxy(hydroxy)methyl]-5-methyl-indol-3-yl]-1-methyl-pyrrole-2,5-dione CAS Name: 3-bromo-4-[1-[hydroxy-[(2-methylpropan-2-yl)oxy]methyl]-5-methyl-3-indolyl]-1-methylpyrrole-2,5-dione IUPAC Name: 3-bromo-4-[1-[hydroxy-[(2-methylpropan-2-yl)oxy]methyl]-5-methylindol-3-yl]-1-methylpyrrole-2,5-dione Traditional Name: 3-bromo-4-[1-[tert-butoxy(hydroxy)methyl]-5-methyl-indol-3-yl]-1-methyl-3-pyrroline-2,5-quinone Formula: C19H21BrN2O4 MolecularWeight: 421.28504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C=C2C3=C(C(=O)N(C3=O)C)Br)C(O)OC(C)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C=C2C3=C(C(=O)N(C3=O)C)Br)C(O)OC(C)(C)C

InChI

InChI=1S/C19H21BrN2O4/c1-10-6-7-13-11(8-10)12(9-22(13)18(25)26-19(2,3)4)14-15(20)17(24)21(5)16(14)23/h6-9,18,25H,1-5H3