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

Systemtic Name: 5-(azepan-1-yl)-2-(2-chlorophenyl)-1,3-oxazole-4-carbonitrile Openeye Name: 5-(azepan-1-yl)-2-(2-chlorophenyl)oxazole-4-carbonitrile CAS Name: 5-(1-azepanyl)-2-(2-chlorophenyl)-4-oxazolecarbonitrile IUPAC Name: 5-(azepan-1-yl)-2-(2-chlorophenyl)-1,3-oxazole-4-carbonitrile Traditional Name: 5-(azepan-1-yl)-2-(2-chlorophenyl)oxazole-4-carbonitrile Formula: C16H16ClN3O MolecularWeight: 301.77074

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(N=C(O2)C3=CC=CC=C3Cl)C#N

Isomeric SMILES

C1CCCN(CC1)C2=C(N=C(O2)C3=CC=CC=C3Cl)C#N

InChI

InChI=1S/C16H16ClN3O/c17-13-8-4-3-7-12(13)15-19-14(11-18)16(21-15)20-9-5-1-2-6-10-20/h3-4,7-8H,1-2,5-6,9-10H2