4-[2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethoxy]-3-methoxy-benzenecarbonitrile

Systemtic Name: 4-[2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethoxy]-3-methoxy-benzenecarbonitrile Openeye Name: 4-[2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-2-oxo-ethoxy]-3-methoxy-benzonitrile CAS Name: 4-[2-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-2-oxoethoxy]-3-methoxybenzonitrile IUPAC Name: 4-[2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-2-oxoethoxy]-3-methoxybenzonitrile Traditional Name: 4-[2-[4-(4-chlorophenyl)sulfonylpiperazino]-2-keto-ethoxy]-3-methoxy-benzonitrile Formula: C20H20ClN3O5S MolecularWeight: 449.9079

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C#N)OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)C#N)OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H20ClN3O5S/c1-28-19-12-15(13-22)2-7-18(19)29-14-20(25)23-8-10-24(11-9-23)30(26,27)17-5-3-16(21)4-6-17/h2-7,12H,8-11,14H2,1H3