1-[[5-[(3-methoxyphenoxy)methyl]-1,2-oxazol-3-yl]carbonyl]-1,4-diazepan-5-one

Systemtic Name: 1-[[5-[(3-methoxyphenoxy)methyl]-1,2-oxazol-3-yl]carbonyl]-1,4-diazepan-5-one Openeye Name: 1-[5-[(3-methoxyphenoxy)methyl]isoxazole-3-carbonyl]-1,4-diazepan-5-one CAS Name: 1-[[5-[(3-methoxyphenoxy)methyl]-3-isoxazolyl]-oxomethyl]-1,4-diazepan-5-one IUPAC Name: 1-[5-[(3-methoxyphenoxy)methyl]-1,2-oxazole-3-carbonyl]-1,4-diazepan-5-one Traditional Name: 1-[5-[(3-methoxyphenoxy)methyl]isoxazole-3-carbonyl]-1,4-diazepan-5-one Formula: C17H19N3O5 MolecularWeight: 345.34986

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)OCC2=CC(=NO2)C(=O)N3CCC(=O)NCC3

Isomeric SMILES

COC1=CC(=CC=C1)OCC2=CC(=NO2)C(=O)N3CCC(=O)NCC3

InChI

InChI=1S/C17H19N3O5/c1-23-12-3-2-4-13(9-12)24-11-14-10-15(19-25-14)17(22)20-7-5-16(21)18-6-8-20/h2-4,9-10H,5-8,11H2,1H3,(H,18,21)