4-[2-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethoxy]benzaldehyde

Systemtic Name: 4-[2-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethoxy]benzaldehyde Openeye Name: 4-[2-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxo-ethoxy]benzaldehyde CAS Name: 4-[2-[4-(2,5-dimethoxyphenyl)sulfonyl-1-piperazinyl]-2-oxoethoxy]benzaldehyde IUPAC Name: 4-[2-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxoethoxy]benzaldehyde Traditional Name: 4-[2-[4-(2,5-dimethoxyphenyl)sulfonylpiperazino]-2-keto-ethoxy]benzaldehyde Formula: C21H24N2O7S MolecularWeight: 448.48946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)C(=O)COC3=CC=C(C=C3)C=O

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)C(=O)COC3=CC=C(C=C3)C=O

InChI

InChI=1S/C21H24N2O7S/c1-28-18-7-8-19(29-2)20(13-18)31(26,27)23-11-9-22(10-12-23)21(25)15-30-17-5-3-16(14-24)4-6-17/h3-8,13-14H,9-12,15H2,1-2H3