3-azanylidene-2-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-oxidanylidene-ethyl]-6-ethoxy-N-methyl-1H-isoindole-5-carboxamide hydrobromide

Systemtic Name: 3-azanylidene-2-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-oxidanylidene-ethyl]-6-ethoxy-N-methyl-1H-isoindole-5-carboxamide hydrobromide Openeye Name: 2-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-oxo-ethyl]-6-ethoxy-3-imino-N-methyl-isoindoline-5-carboxamide hydrobromide CAS Name: 2-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-6-ethoxy-3-imino-N-methyl-1H-isoindole-5-carboxamide hydrobromide IUPAC Name: 2-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-6-ethoxy-3-imino-N-methyl-1H-isoindole-5-carboxamide hydrobromide Traditional Name: 2-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-keto-ethyl]-6-ethoxy-3-imino-N-methyl-isoindoline-5-carboxamide hydrobromide Formula: C28H38BrN3O4 MolecularWeight: 560.52302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CN(C2=N)CC(=O)C3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)C(=O)NC.Br

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CN(C2=N)CC(=O)C3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)C(=O)NC.Br

InChI

InChI=1S/C28H37N3O4.BrH/c1-9-35-23-12-17-14-31(25(29)18(17)13-19(23)26(34)30-8)15-22(32)16-10-20(27(2,3)4)24(33)21(11-16)28(5,6)7;/h10-13,29,33H,9,14-15H2,1-8H3,(H,30,34);1H