N-(4-tert-butylphenyl)-7-methoxy-4-[(phenethylamino)methyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-(4-tert-butylphenyl)-7-methoxy-4-[(phenethylamino)methyl]-1-benzofuran-2-carboxamide Openeye Name: N-(4-tert-butylphenyl)-7-methoxy-4-[(phenethylamino)methyl]benzofuran-2-carboxamide CAS Name: N-(4-tert-butylphenyl)-7-methoxy-4-[(phenethylamino)methyl]-2-benzofurancarboxamide IUPAC Name: N-(4-tert-butylphenyl)-7-methoxy-4-[(phenethylamino)methyl]-1-benzofuran-2-carboxamide Traditional Name: N-(4-tert-butylphenyl)-7-methoxy-4-[(phenethylamino)methyl]coumarilamide Formula: C29H32N2O3 MolecularWeight: 456.57598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=CC(=C3O2)OC)CNCCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=CC(=C3O2)OC)CNCCC4=CC=CC=C4

InChI

InChI=1S/C29H32N2O3/c1-29(2,3)22-11-13-23(14-12-22)31-28(32)26-18-24-21(10-15-25(33-4)27(24)34-26)19-30-17-16-20-8-6-5-7-9-20/h5-15,18,30H,16-17,19H2,1-4H3,(H,31,32)