2,5-dimethyl-4-[4-(phenylsulfonyl)piperazin-1-yl]benzaldehyde

Systemtic Name: 2,5-dimethyl-4-[4-(phenylsulfonyl)piperazin-1-yl]benzaldehyde Openeye Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-2,5-dimethyl-benzaldehyde CAS Name: 4-[4-(benzenesulfonyl)-1-piperazinyl]-2,5-dimethylbenzaldehyde IUPAC Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-2,5-dimethylbenzaldehyde Traditional Name: 4-(4-besylpiperazino)-2,5-dimethyl-benzaldehyde Formula: C19H22N2O3S MolecularWeight: 358.45458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C=O)C)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1C=O)C)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H22N2O3S/c1-15-13-19(16(2)12-17(15)14-22)20-8-10-21(11-9-20)25(23,24)18-6-4-3-5-7-18/h3-7,12-14H,8-11H2,1-2H3