5-[4-(3-chlorophenyl)carbonylpiperazin-1-yl]-2-(3,4-dimethoxyphenyl)-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-[4-(3-chlorophenyl)carbonylpiperazin-1-yl]-2-(3,4-dimethoxyphenyl)-1,3-oxazole-4-carbonitrile Openeye Name: 5-[4-(3-chlorobenzoyl)piperazin-1-yl]-2-(3,4-dimethoxyphenyl)oxazole-4-carbonitrile CAS Name: 5-[4-[(3-chlorophenyl)-oxomethyl]-1-piperazinyl]-2-(3,4-dimethoxyphenyl)-4-oxazolecarbonitrile IUPAC Name: 5-[4-(3-chlorobenzoyl)piperazin-1-yl]-2-(3,4-dimethoxyphenyl)-1,3-oxazole-4-carbonitrile Traditional Name: 5-[4-(3-chlorobenzoyl)piperazino]-2-(3,4-dimethoxyphenyl)oxazole-4-carbonitrile Formula: C23H21ClN4O4 MolecularWeight: 452.89024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=C(O2)N3CCN(CC3)C(=O)C4=CC(=CC=C4)Cl)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=C(O2)N3CCN(CC3)C(=O)C4=CC(=CC=C4)Cl)C#N)OC

InChI

InChI=1S/C23H21ClN4O4/c1-30-19-7-6-15(13-20(19)31-2)21-26-18(14-25)23(32-21)28-10-8-27(9-11-28)22(29)16-4-3-5-17(24)12-16/h3-7,12-13H,8-11H2,1-2H3