ditert-butyl (E)-2-(N-tert-butyl-C-pyrrol-1-yl-carbonimidoyl)but-2-enedioate

Systemtic Name: ditert-butyl (E)-2-(N-tert-butyl-C-pyrrol-1-yl-carbonimidoyl)but-2-enedioate Openeye Name: ditert-butyl (E)-2-(N-tert-butyl-C-pyrrol-1-yl-carbonimidoyl)but-2-enedioate CAS Name: (E)-2-[tert-butylimino(1-pyrrolyl)methyl]-2-butenedioic acid ditert-butyl ester IUPAC Name: ditert-butyl (E)-2-(N-tert-butyl-C-pyrrol-1-ylcarbonimidoyl)but-2-enedioate Traditional Name: (E)-2-(N-tert-butyl-C-pyrrol-1-yl-carbonimidoyl)but-2-enedioic acid ditert-butyl ester Formula: C21H32N2O4 MolecularWeight: 376.48978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N=C(C(=CC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)N1C=CC=C1

Isomeric SMILES

CC(C)(C)N=C(/C(=C\C(=O)OC(C)(C)C)/C(=O)OC(C)(C)C)N1C=CC=C1

InChI

InChI=1S/C21H32N2O4/c1-19(2,3)22-17(23-12-10-11-13-23)15(18(25)27-21(7,8)9)14-16(24)26-20(4,5)6/h10-14H,1-9H3/b15-14+,22-17?