[2-(phenylsulfonylimino)-4,5,6,7-tetrahydro-1-benzothiophen-3-ylidene]-propan-2-yloxy-methanolate

Systemtic Name: [2-(phenylsulfonylimino)-4,5,6,7-tetrahydro-1-benzothiophen-3-ylidene]-propan-2-yloxy-methanolate Openeye Name: [2-(benzenesulfonylimino)-4,5,6,7-tetrahydrobenzothiophen-3-ylidene]-isopropoxy-methanolate CAS Name: [2-(benzenesulfonylimino)-4,5,6,7-tetrahydro-1-benzothiophen-3-ylidene]-propan-2-yloxymethanolate IUPAC Name: [2-(benzenesulfonylimino)-4,5,6,7-tetrahydro-1-benzothiophen-3-ylidene]-propan-2-yloxymethanolate Traditional Name: (2-besylimino-4,5,6,7-tetrahydrobenzothiophen-3-ylidene)-isopropoxy-methanolate Formula: C18H20NO4S2- MolecularWeight: 378.4857

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=C1C2=C(CCCC2)SC1=NS(=O)(=O)C3=CC=CC=C3)[O-]

Isomeric SMILES

CC(C)OC(=C1C2=C(CCCC2)SC1=NS(=O)(=O)C3=CC=CC=C3)[O-]

InChI

InChI=1S/C18H21NO4S2/c1-12(2)23-18(20)16-14-10-6-7-11-15(14)24-17(16)19-25(21,22)13-8-4-3-5-9-13/h3-5,8-9,12,20H,6-7,10-11H2,1-2H3/p-1