dimethyl (E)-2-[2-(3,3-dimethylbut-1-en-2-yl)-1-methyl-indol-3-yl]but-2-enedioate

Systemtic Name: dimethyl (E)-2-[2-(3,3-dimethylbut-1-en-2-yl)-1-methyl-indol-3-yl]but-2-enedioate Openeye Name: dimethyl (E)-2-[2-(2,2-dimethyl-1-methylene-propyl)-1-methyl-indol-3-yl]but-2-enedioate CAS Name: (E)-2-[2-(3,3-dimethylbut-1-en-2-yl)-1-methyl-3-indolyl]-2-butenedioic acid dimethyl ester IUPAC Name: dimethyl (E)-2-[2-(3,3-dimethylbut-1-en-2-yl)-1-methylindol-3-yl]but-2-enedioate Traditional Name: (E)-2-[2-(1-tert-butylvinyl)-1-methyl-indol-3-yl]but-2-enedioic acid dimethyl ester Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=C)C1=C(C2=CC=CC=C2N1C)C(=CC(=O)OC)C(=O)OC

Isomeric SMILES

CC(C)(C)C(=C)C1=C(C2=CC=CC=C2N1C)/C(=C\C(=O)OC)/C(=O)OC

InChI

InChI=1S/C21H25NO4/c1-13(21(2,3)4)19-18(14-10-8-9-11-16(14)22(19)5)15(20(24)26-7)12-17(23)25-6/h8-12H,1H2,2-7H3/b15-12+