3-[(4-bromophenyl)methylidene]-2-morpholin-4-yl-N-(3,4,5-trimethoxyphenyl)cyclohexene-1-carboxamide

Systemtic Name: 3-[(4-bromophenyl)methylidene]-2-morpholin-4-yl-N-(3,4,5-trimethoxyphenyl)cyclohexene-1-carboxamide Openeye Name: 3-[(4-bromophenyl)methylene]-2-morpholino-N-(3,4,5-trimethoxyphenyl)cyclohexene-1-carboxamide CAS Name: 3-[(4-bromophenyl)methylidene]-2-(4-morpholinyl)-N-(3,4,5-trimethoxyphenyl)-1-cyclohexenecarboxamide IUPAC Name: 3-[(4-bromophenyl)methylidene]-2-morpholin-4-yl-N-(3,4,5-trimethoxyphenyl)cyclohexene-1-carboxamide Traditional Name: 3-(4-bromobenzylidene)-2-morpholino-N-(3,4,5-trimethoxyphenyl)cyclohexene-1-carboxamide Formula: C27H31BrN2O5 MolecularWeight: 543.44944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)C2=C(C(=CC3=CC=C(C=C3)Br)CCC2)N4CCOCC4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)C2=C(C(=CC3=CC=C(C=C3)Br)CCC2)N4CCOCC4

InChI

InChI=1S/C27H31BrN2O5/c1-32-23-16-21(17-24(33-2)26(23)34-3)29-27(31)22-6-4-5-19(15-18-7-9-20(28)10-8-18)25(22)30-11-13-35-14-12-30/h7-10,15-17H,4-6,11-14H2,1-3H3,(H,29,31)