5-(azepan-1-yl)-2-[(2-methoxyphenoxy)methyl]-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-(azepan-1-yl)-2-[(2-methoxyphenoxy)methyl]-1,3-oxazole-4-carbonitrile Openeye Name: 5-(azepan-1-yl)-2-[(2-methoxyphenoxy)methyl]oxazole-4-carbonitrile CAS Name: 5-(1-azepanyl)-2-[(2-methoxyphenoxy)methyl]-4-oxazolecarbonitrile IUPAC Name: 5-(azepan-1-yl)-2-[(2-methoxyphenoxy)methyl]-1,3-oxazole-4-carbonitrile Traditional Name: 5-(azepan-1-yl)-2-[(2-methoxyphenoxy)methyl]oxazole-4-carbonitrile Formula: C18H21N3O3 MolecularWeight: 327.37764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OCC2=NC(=C(O2)N3CCCCCC3)C#N

Isomeric SMILES

COC1=CC=CC=C1OCC2=NC(=C(O2)N3CCCCCC3)C#N

InChI

InChI=1S/C18H21N3O3/c1-22-15-8-4-5-9-16(15)23-13-17-20-14(12-19)18(24-17)21-10-6-2-3-7-11-21/h4-5,8-9H,2-3,6-7,10-11,13H2,1H3