(3-methoxy-4-propan-2-yloxy-phenyl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone

Systemtic Name: (3-methoxy-4-propan-2-yloxy-phenyl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone Openeye Name: [4-(benzenesulfonyl)piperazin-1-yl]-(4-isopropoxy-3-methoxy-phenyl)methanone CAS Name: [4-(benzenesulfonyl)-1-piperazinyl]-(3-methoxy-4-propan-2-yloxyphenyl)methanone IUPAC Name: [4-(benzenesulfonyl)piperazin-1-yl]-(3-methoxy-4-propan-2-yloxyphenyl)methanone Traditional Name: (4-besylpiperazino)-(4-isopropoxy-3-methoxy-phenyl)methanone Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C21H26N2O5S/c1-16(2)28-19-10-9-17(15-20(19)27-3)21(24)22-11-13-23(14-12-22)29(25,26)18-7-5-4-6-8-18/h4-10,15-16H,11-14H2,1-3H3