5-[4-(3-chlorophenyl)piperazin-1-yl]-2-[(4-phenylphenoxy)methyl]-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-[4-(3-chlorophenyl)piperazin-1-yl]-2-[(4-phenylphenoxy)methyl]-1,3-oxazole-4-carbonitrile Openeye Name: 5-[4-(3-chlorophenyl)piperazin-1-yl]-2-[(4-phenylphenoxy)methyl]oxazole-4-carbonitrile CAS Name: 5-[4-(3-chlorophenyl)-1-piperazinyl]-2-[(4-phenylphenoxy)methyl]-4-oxazolecarbonitrile IUPAC Name: 5-[4-(3-chlorophenyl)piperazin-1-yl]-2-[(4-phenylphenoxy)methyl]-1,3-oxazole-4-carbonitrile Traditional Name: 5-[4-(3-chlorophenyl)piperazino]-2-[(4-phenylphenoxy)methyl]oxazole-4-carbonitrile Formula: C27H23ClN4O2 MolecularWeight: 470.95012

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=C(N=C(O3)COC4=CC=C(C=C4)C5=CC=CC=C5)C#N

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=C(N=C(O3)COC4=CC=C(C=C4)C5=CC=CC=C5)C#N

InChI

InChI=1S/C27H23ClN4O2/c28-22-7-4-8-23(17-22)31-13-15-32(16-14-31)27-25(18-29)30-26(34-27)19-33-24-11-9-21(10-12-24)20-5-2-1-3-6-20/h1-12,17H,13-16,19H2