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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OCC2=NC(=C(O2)N3CCN(CC3)C4=CC(=CC=C4)Cl)C#N

Isomeric SMILES

COC1=CC=CC=C1OCC2=NC(=C(O2)N3CCN(CC3)C4=CC(=CC=C4)Cl)C#N

InChI

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