2-[4-[1,1-bis(oxidanylidene)-2-phenyl-2,3-dihydro-1-benzothiophen-3-yl]piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[1,1-bis(oxidanylidene)-2-phenyl-2,3-dihydro-1-benzothiophen-3-yl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(1,1-dioxo-2-phenyl-2,3-dihydrobenzothiophen-3-yl)piperazin-1-yl]acetic acid CAS Name: 2-[4-(1,1-dioxo-2-phenyl-2,3-dihydro-1-benzothiophen-3-yl)-1-piperazinyl]acetic acid IUPAC Name: 2-[4-(1,1-dioxo-2-phenyl-2,3-dihydro-1-benzothiophen-3-yl)piperazin-1-yl]acetic acid Traditional Name: 2-[4-(1,1-diketo-2-phenyl-2,3-dihydrobenzothiophen-3-yl)piperazino]acetic acid Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)O)C2C(S(=O)(=O)C3=CC=CC=C23)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC(=O)O)C2C(S(=O)(=O)C3=CC=CC=C23)C4=CC=CC=C4

InChI

InChI=1S/C20H22N2O4S/c23-18(24)14-21-10-12-22(13-11-21)19-16-8-4-5-9-17(16)27(25,26)20(19)15-6-2-1-3-7-15/h1-9,19-20H,10-14H2,(H,23,24)