(4-pentoxyphenyl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone

Systemtic Name: (4-pentoxyphenyl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone Openeye Name: [4-(benzenesulfonyl)piperazin-1-yl]-(4-pentoxyphenyl)methanone CAS Name: [4-(benzenesulfonyl)-1-piperazinyl]-(4-pentoxyphenyl)methanone IUPAC Name: [4-(benzenesulfonyl)piperazin-1-yl]-(4-pentoxyphenyl)methanone Traditional Name: (4-amoxyphenyl)-(4-besylpiperazino)methanone Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H28N2O4S/c1-2-3-7-18-28-20-12-10-19(11-13-20)22(25)23-14-16-24(17-15-23)29(26,27)21-8-5-4-6-9-21/h4-6,8-13H,2-3,7,14-18H2,1H3