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

Systemtic Name: 5-(azepan-1-yl)-2-(4-methylphenyl)-1,3-oxazole-4-carbonitrile Openeye Name: 5-(azepan-1-yl)-2-(p-tolyl)oxazole-4-carbonitrile CAS Name: 5-(1-azepanyl)-2-(4-methylphenyl)-4-oxazolecarbonitrile IUPAC Name: 5-(azepan-1-yl)-2-(4-methylphenyl)-1,3-oxazole-4-carbonitrile Traditional Name: 5-(azepan-1-yl)-2-(p-tolyl)oxazole-4-carbonitrile Formula: C17H19N3O MolecularWeight: 281.35226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(O2)N3CCCCCC3)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(O2)N3CCCCCC3)C#N

InChI

InChI=1S/C17H19N3O/c1-13-6-8-14(9-7-13)16-19-15(12-18)17(21-16)20-10-4-2-3-5-11-20/h6-9H,2-5,10-11H2,1H3