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

Systemtic Name: 5-(azepan-1-yl)-2-[(3-chloranylphenoxy)methyl]-1,3-oxazole-4-carbonitrile Openeye Name: 5-(azepan-1-yl)-2-[(3-chlorophenoxy)methyl]oxazole-4-carbonitrile CAS Name: 5-(1-azepanyl)-2-[(3-chlorophenoxy)methyl]-4-oxazolecarbonitrile IUPAC Name: 5-(azepan-1-yl)-2-[(3-chlorophenoxy)methyl]-1,3-oxazole-4-carbonitrile Traditional Name: 5-(azepan-1-yl)-2-[(3-chlorophenoxy)methyl]oxazole-4-carbonitrile Formula: C17H18ClN3O2 MolecularWeight: 331.79672

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(N=C(O2)COC3=CC(=CC=C3)Cl)C#N

Isomeric SMILES

C1CCCN(CC1)C2=C(N=C(O2)COC3=CC(=CC=C3)Cl)C#N

InChI

InChI=1S/C17H18ClN3O2/c18-13-6-5-7-14(10-13)22-12-16-20-15(11-19)17(23-16)21-8-3-1-2-4-9-21/h5-7,10H,1-4,8-9,12H2