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

Systemtic Name: 3-azanyl-N-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-oxidanylidene-ethyl]-6-ethoxy-1H-isoindole-5-carboxamide hydrobromide Openeye Name: 3-amino-N-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-oxo-ethyl]-6-ethoxy-1H-isoindole-5-carboxamide hydrobromide CAS Name: 3-amino-N-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-6-ethoxy-1H-isoindole-5-carboxamide hydrobromide IUPAC Name: 3-amino-N-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-6-ethoxy-1H-isoindole-5-carboxamide hydrobromide Traditional Name: 3-amino-N-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-keto-ethyl]-6-ethoxy-1H-isoindole-5-carboxamide hydrobromide Formula: C27H36BrN3O4 MolecularWeight: 546.49644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CN=C2N)C(=O)NCC(=O)C3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C.Br

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CN=C2N)C(=O)NCC(=O)C3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C.Br

InChI

InChI=1S/C27H35N3O4.BrH/c1-8-34-22-11-16-13-29-24(28)17(16)12-18(22)25(33)30-14-21(31)15-9-19(26(2,3)4)23(32)20(10-15)27(5,6)7;/h9-12,32H,8,13-14H2,1-7H3,(H2,28,29)(H,30,33);1H