diethyl-[(1E)-5-hexoxy-5-oxidanylidene-4-(phenylsulfonyl)penta-1,3-dienyl]azanium

Systemtic Name: diethyl-[(1E)-5-hexoxy-5-oxidanylidene-4-(phenylsulfonyl)penta-1,3-dienyl]azanium Openeye Name: [(1E)-4-(benzenesulfonyl)-5-hexoxy-5-oxo-penta-1,3-dienyl]-diethyl-ammonium CAS Name: [(1E)-4-(benzenesulfonyl)-5-hexoxy-5-oxopenta-1,3-dienyl]-diethylammonium IUPAC Name: [(1E)-4-(benzenesulfonyl)-5-hexoxy-5-oxopenta-1,3-dienyl]-diethylazanium Traditional Name: [(1E)-4-besyl-5-hexoxy-5-keto-penta-1,3-dienyl]-diethyl-ammonium Formula: C21H32NO4S+ MolecularWeight: 394.54808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C(=CC=C[NH+](CC)CC)S(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCCCOC(=O)C(=C/C=C/[NH+](CC)CC)S(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C21H31NO4S/c1-4-7-8-12-18-26-21(23)20(16-13-17-22(5-2)6-3)27(24,25)19-14-10-9-11-15-19/h9-11,13-17H,4-8,12,18H2,1-3H3/p+1/b17-13+,20-16?