(2-ethylsulfonylphenyl)carbonyl-(4-methyl-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene)azanium

Systemtic Name: (2-ethylsulfonylphenyl)carbonyl-(4-methyl-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene)azanium Openeye Name: (2-ethylsulfonylbenzoyl)-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)ammonium CAS Name: [(2-ethylsulfonylphenyl)-oxomethyl]-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydro-1-benzopyran-7-ylidene)ammonium IUPAC Name: (2-ethylsulfonylbenzoyl)-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)azanium Traditional Name: (2-esylbenzoyl)-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)ammonium Formula: C19H22NO5S+ MolecularWeight: 376.44668

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=CC=C1C(=O)[NH+]=C2CCC3=C(C=C(OC3C2)O)C

Isomeric SMILES

CCS(=O)(=O)C1=CC=CC=C1C(=O)[NH+]=C2CCC3=C(C=C(OC3C2)O)C

InChI

InChI=1S/C19H21NO5S/c1-3-26(23,24)17-7-5-4-6-15(17)19(22)20-13-8-9-14-12(2)10-18(21)25-16(14)11-13/h4-7,10,16,21H,3,8-9,11H2,1-2H3/p+1