2-[(3,4-dimethoxyphenyl)methyl]-N-(2-imidazol-1-ylethyl)-1,3-benzoxazole-6-carboxamide

Systemtic Name: 2-[(3,4-dimethoxyphenyl)methyl]-N-(2-imidazol-1-ylethyl)-1,3-benzoxazole-6-carboxamide Openeye Name: 2-[(3,4-dimethoxyphenyl)methyl]-N-(2-imidazol-1-ylethyl)-1,3-benzoxazole-6-carboxamide CAS Name: 2-[(3,4-dimethoxyphenyl)methyl]-N-[2-(1-imidazolyl)ethyl]-1,3-benzoxazole-6-carboxamide IUPAC Name: 2-[(3,4-dimethoxyphenyl)methyl]-N-(2-imidazol-1-ylethyl)-1,3-benzoxazole-6-carboxamide Traditional Name: N-(2-imidazol-1-ylethyl)-2-veratryl-1,3-benzoxazole-6-carboxamide Formula: C22H22N4O4 MolecularWeight: 406.43448

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2=NC3=C(O2)C=C(C=C3)C(=O)NCCN4C=CN=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC2=NC3=C(O2)C=C(C=C3)C(=O)NCCN4C=CN=C4)OC

InChI

InChI=1S/C22H22N4O4/c1-28-18-6-3-15(11-20(18)29-2)12-21-25-17-5-4-16(13-19(17)30-21)22(27)24-8-10-26-9-7-23-14-26/h3-7,9,11,13-14H,8,10,12H2,1-2H3,(H,24,27)