3-chloranyl-4-[2-(4-ethanoylpiperazin-1-yl)-2-oxidanylidene-ethoxy]benzenecarbonitrile

Systemtic Name: 3-chloranyl-4-[2-(4-ethanoylpiperazin-1-yl)-2-oxidanylidene-ethoxy]benzenecarbonitrile Openeye Name: 4-[2-(4-acetylpiperazin-1-yl)-2-oxo-ethoxy]-3-chloro-benzonitrile CAS Name: 4-[2-(4-acetyl-1-piperazinyl)-2-oxoethoxy]-3-chlorobenzonitrile IUPAC Name: 4-[2-(4-acetylpiperazin-1-yl)-2-oxoethoxy]-3-chlorobenzonitrile Traditional Name: 4-[2-(4-acetylpiperazino)-2-keto-ethoxy]-3-chloro-benzonitrile Formula: C15H16ClN3O3 MolecularWeight: 321.75884

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)COC2=C(C=C(C=C2)C#N)Cl

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)COC2=C(C=C(C=C2)C#N)Cl

InChI

InChI=1S/C15H16ClN3O3/c1-11(20)18-4-6-19(7-5-18)15(21)10-22-14-3-2-12(9-17)8-13(14)16/h2-3,8H,4-7,10H2,1H3