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

Systemtic Name: 5-(azepan-1-yl)-2-phenyl-1,3-oxazole-4-carbonitrile Openeye Name: 5-(azepan-1-yl)-2-phenyl-oxazole-4-carbonitrile CAS Name: 5-(1-azepanyl)-2-phenyl-4-oxazolecarbonitrile IUPAC Name: 5-(azepan-1-yl)-2-phenyl-1,3-oxazole-4-carbonitrile Traditional Name: 5-(azepan-1-yl)-2-phenyl-oxazole-4-carbonitrile Formula: C16H17N3O MolecularWeight: 267.32568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O/c17-12-14-16(19-10-6-1-2-7-11-19)20-15(18-14)13-8-4-3-5-9-13/h3-5,8-9H,1-2,6-7,10-11H2