2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(6-ethyl-4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methyl]-methyl-azanium

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(6-ethyl-4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methyl]-methyl-azanium Openeye Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(6-ethyl-7-hydroxy-4-methyl-2-oxo-chromen-8-yl)methyl]-methyl-ammonium CAS Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(6-ethyl-7-hydroxy-4-methyl-2-oxo-1-benzopyran-8-yl)methyl]-methylammonium IUPAC Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(6-ethyl-7-hydroxy-4-methyl-2-oxochromen-8-yl)methyl]-methylazanium Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(6-ethyl-7-hydroxy-2-keto-4-methyl-chromen-8-yl)methyl]-methyl-ammonium Formula: C23H26NO5+ MolecularWeight: 396.45624

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C(=C1)C(=CC(=O)O2)C)C[NH+](C)CC3=CC4=C(C=C3)OCCO4)O

Isomeric SMILES

CCC1=C(C(=C2C(=C1)C(=CC(=O)O2)C)C[NH+](C)CC3=CC4=C(C=C3)OCCO4)O

InChI

InChI=1S/C23H25NO5/c1-4-16-11-17-14(2)9-21(25)29-23(17)18(22(16)26)13-24(3)12-15-5-6-19-20(10-15)28-8-7-27-19/h5-6,9-11,26H,4,7-8,12-13H2,1-3H3/p+1