[2-oxidanyl-3-[(2,3,5-trimethylphenyl)sulfonylamino]chromen-4-ylidene]-propyl-azanium

Systemtic Name: [2-oxidanyl-3-[(2,3,5-trimethylphenyl)sulfonylamino]chromen-4-ylidene]-propyl-azanium Openeye Name: [2-hydroxy-3-[(2,3,5-trimethylphenyl)sulfonylamino]chromen-4-ylidene]-propyl-ammonium CAS Name: [2-hydroxy-3-[(2,3,5-trimethylphenyl)sulfonylamino]-1-benzopyran-4-ylidene]-propylammonium IUPAC Name: [2-hydroxy-3-[(2,3,5-trimethylphenyl)sulfonylamino]chromen-4-ylidene]-propylazanium Traditional Name: [2-hydroxy-3-[(2,3,5-trimethylphenyl)sulfonylamino]chromen-4-ylidene]-propyl-ammonium Formula: C21H25N2O4S+ MolecularWeight: 401.4992

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]=C1C2=CC=CC=C2OC(=C1NS(=O)(=O)C3=CC(=CC(=C3C)C)C)O

Isomeric SMILES

CCC[NH+]=C1C2=CC=CC=C2OC(=C1NS(=O)(=O)C3=CC(=CC(=C3C)C)C)O

InChI

InChI=1S/C21H24N2O4S/c1-5-10-22-19-16-8-6-7-9-17(16)27-21(24)20(19)23-28(25,26)18-12-13(2)11-14(3)15(18)4/h6-9,11-12,23-24H,5,10H2,1-4H3/p+1