(6-ethyl-4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methyl-methyl-(phenylmethyl)azanium

Systemtic Name: (6-ethyl-4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[(6-ethyl-7-hydroxy-4-methyl-2-oxo-chromen-8-yl)methyl]-methyl-ammonium CAS Name: (6-ethyl-7-hydroxy-4-methyl-2-oxo-1-benzopyran-8-yl)methyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[(6-ethyl-7-hydroxy-4-methyl-2-oxochromen-8-yl)methyl]-methylazanium Traditional Name: benzyl-[(6-ethyl-7-hydroxy-2-keto-4-methyl-chromen-8-yl)methyl]-methyl-ammonium Formula: C21H24NO3+ MolecularWeight: 338.42016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23NO3/c1-4-16-11-17-14(2)10-19(23)25-21(17)18(20(16)24)13-22(3)12-15-8-6-5-7-9-15/h5-11,24H,4,12-13H2,1-3H3/p+1