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

Systemtic Name: 3-azanylidene-2-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-oxidanylidene-ethyl]-6-(dimethylamino)-N-methyl-1H-isoindole-5-carboxamide hydrobromide Openeye Name: 2-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-oxo-ethyl]-6-(dimethylamino)-3-imino-N-methyl-isoindoline-5-carboxamide hydrobromide CAS Name: 2-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-6-(dimethylamino)-3-imino-N-methyl-1H-isoindole-5-carboxamide hydrobromide IUPAC Name: 2-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-6-(dimethylamino)-3-imino-N-methyl-1H-isoindole-5-carboxamide hydrobromide Traditional Name: 2-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-keto-ethyl]-6-(dimethylamino)-3-imino-N-methyl-isoindoline-5-carboxamide hydrobromide Formula: C28H39BrN4O3 MolecularWeight: 559.53826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)CN2CC3=CC(=C(C=C3C2=N)C(=O)NC)N(C)C.Br

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)CN2CC3=CC(=C(C=C3C2=N)C(=O)NC)N(C)C.Br

InChI

InChI=1S/C28H38N4O3.BrH/c1-27(2,3)20-10-16(11-21(24(20)34)28(4,5)6)23(33)15-32-14-17-12-22(31(8)9)19(26(35)30-7)13-18(17)25(32)29;/h10-13,29,34H,14-15H2,1-9H3,(H,30,35);1H