(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl-[(3-methoxyphenyl)methyl]-methyl-azanium

Systemtic Name: (6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl-[(3-methoxyphenyl)methyl]-methyl-azanium Openeye Name: (6-ethyl-7-hydroxy-2-oxo-chromen-4-yl)methyl-[(3-methoxyphenyl)methyl]-methyl-ammonium CAS Name: (6-ethyl-7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl-[(3-methoxyphenyl)methyl]-methylammonium IUPAC Name: (6-ethyl-7-hydroxy-2-oxochromen-4-yl)methyl-[(3-methoxyphenyl)methyl]-methylazanium Traditional Name: (6-ethyl-7-hydroxy-2-keto-chromen-4-yl)methyl-m-anisyl-methyl-ammonium Formula: C21H24NO4+ MolecularWeight: 354.41956

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH+](C)CC3=CC(=CC=C3)OC)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH+](C)CC3=CC(=CC=C3)OC)O

InChI

InChI=1S/C21H23NO4/c1-4-15-9-18-16(10-21(24)26-20(18)11-19(15)23)13-22(2)12-14-6-5-7-17(8-14)25-3/h5-11,23H,4,12-13H2,1-3H3/p+1