3-azanylidene-2-[2-(3-tert-butyl-4-methoxy-5-propan-2-yloxy-phenyl)-2-oxidanylidene-ethyl]-6-ethoxy-N-methyl-1H-isoindole-5-carboxamide hydrobromide

Systemtic Name: 3-azanylidene-2-[2-(3-tert-butyl-4-methoxy-5-propan-2-yloxy-phenyl)-2-oxidanylidene-ethyl]-6-ethoxy-N-methyl-1H-isoindole-5-carboxamide hydrobromide Openeye Name: 2-[2-(3-tert-butyl-5-isopropoxy-4-methoxy-phenyl)-2-oxo-ethyl]-6-ethoxy-3-imino-N-methyl-isoindoline-5-carboxamide hydrobromide CAS Name: 2-[2-(3-tert-butyl-4-methoxy-5-propan-2-yloxyphenyl)-2-oxoethyl]-6-ethoxy-3-imino-N-methyl-1H-isoindole-5-carboxamide hydrobromide IUPAC Name: 2-[2-(3-tert-butyl-4-methoxy-5-propan-2-yloxyphenyl)-2-oxoethyl]-6-ethoxy-3-imino-N-methyl-1H-isoindole-5-carboxamide hydrobromide Traditional Name: 2-[2-(3-tert-butyl-5-isopropoxy-4-methoxy-phenyl)-2-keto-ethyl]-6-ethoxy-3-imino-N-methyl-isoindoline-5-carboxamide hydrobromide Formula: C28H38BrN3O5 MolecularWeight: 576.52242

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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)OC(C)C)OC)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)OC(C)C)OC)C(C)(C)C)C(=O)NC.Br

InChI

InChI=1S/C28H37N3O5.BrH/c1-9-35-23-12-18-14-31(26(29)19(18)13-20(23)27(33)30-7)15-22(32)17-10-21(28(4,5)6)25(34-8)24(11-17)36-16(2)3;/h10-13,16,29H,9,14-15H2,1-8H3,(H,30,33);1H