(7-ethoxy-1-benzofuran-2-yl)-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]-1,4-diazepan-1-yl]methanone

Systemtic Name: (7-ethoxy-1-benzofuran-2-yl)-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]-1,4-diazepan-1-yl]methanone Openeye Name: (7-ethoxybenzofuran-2-yl)-[4-[(5-methylisoxazol-3-yl)methyl]-1,4-diazepan-1-yl]methanone CAS Name: (7-ethoxy-2-benzofuranyl)-[4-[(5-methyl-3-isoxazolyl)methyl]-1,4-diazepan-1-yl]methanone IUPAC Name: (7-ethoxy-1-benzofuran-2-yl)-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]-1,4-diazepan-1-yl]methanone Traditional Name: (7-ethoxybenzofuran-2-yl)-[4-[(5-methylisoxazol-3-yl)methyl]-1,4-diazepan-1-yl]methanone Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C1OC(=C2)C(=O)N3CCCN(CC3)CC4=NOC(=C4)C

Isomeric SMILES

CCOC1=CC=CC2=C1OC(=C2)C(=O)N3CCCN(CC3)CC4=NOC(=C4)C

InChI

InChI=1S/C21H25N3O4/c1-3-26-18-7-4-6-16-13-19(27-20(16)18)21(25)24-9-5-8-23(10-11-24)14-17-12-15(2)28-22-17/h4,6-7,12-13H,3,5,8-11,14H2,1-2H3