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

Systemtic Name: 2-[(3-chloranylphenoxy)methyl]-5-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3-oxazole-4-carbonitrile Openeye Name: 2-[(3-chlorophenoxy)methyl]-5-[4-(4-methoxyphenyl)piperazin-1-yl]oxazole-4-carbonitrile CAS Name: 2-[(3-chlorophenoxy)methyl]-5-[4-(4-methoxyphenyl)-1-piperazinyl]-4-oxazolecarbonitrile IUPAC Name: 2-[(3-chlorophenoxy)methyl]-5-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3-oxazole-4-carbonitrile Traditional Name: 2-[(3-chlorophenoxy)methyl]-5-[4-(4-methoxyphenyl)piperazino]oxazole-4-carbonitrile Formula: C22H21ClN4O3 MolecularWeight: 424.88014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C3=C(N=C(O3)COC4=CC(=CC=C4)Cl)C#N

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C3=C(N=C(O3)COC4=CC(=CC=C4)Cl)C#N

InChI

InChI=1S/C22H21ClN4O3/c1-28-18-7-5-17(6-8-18)26-9-11-27(12-10-26)22-20(14-24)25-21(30-22)15-29-19-4-2-3-16(23)13-19/h2-8,13H,9-12,15H2,1H3