5-(azepan-1-yl)-2-(4-ethoxyphenyl)-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-(azepan-1-yl)-2-(4-ethoxyphenyl)-1,3-oxazole-4-carbonitrile Openeye Name: 5-(azepan-1-yl)-2-(4-ethoxyphenyl)oxazole-4-carbonitrile CAS Name: 5-(1-azepanyl)-2-(4-ethoxyphenyl)-4-oxazolecarbonitrile IUPAC Name: 5-(azepan-1-yl)-2-(4-ethoxyphenyl)-1,3-oxazole-4-carbonitrile Traditional Name: 5-(azepan-1-yl)-2-p-phenetyl-oxazole-4-carbonitrile Formula: C18H21N3O2 MolecularWeight: 311.37824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC(=C(O2)N3CCCCCC3)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC(=C(O2)N3CCCCCC3)C#N

InChI

InChI=1S/C18H21N3O2/c1-2-22-15-9-7-14(8-10-15)17-20-16(13-19)18(23-17)21-11-5-3-4-6-12-21/h7-10H,2-6,11-12H2,1H3