[3-(2-methylpropoxy)phenyl]-[4-(phenylsulfonyl)piperazin-1-yl]methanone

Systemtic Name: [3-(2-methylpropoxy)phenyl]-[4-(phenylsulfonyl)piperazin-1-yl]methanone Openeye Name: [4-(benzenesulfonyl)piperazin-1-yl]-(3-isobutoxyphenyl)methanone CAS Name: [4-(benzenesulfonyl)-1-piperazinyl]-[3-(2-methylpropoxy)phenyl]methanone IUPAC Name: [4-(benzenesulfonyl)piperazin-1-yl]-[3-(2-methylpropoxy)phenyl]methanone Traditional Name: (4-besylpiperazino)-(3-isobutoxyphenyl)methanone Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O4S/c1-17(2)16-27-19-8-6-7-18(15-19)21(24)22-11-13-23(14-12-22)28(25,26)20-9-4-3-5-10-20/h3-10,15,17H,11-14,16H2,1-2H3