[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl]azanium

Systemtic Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl]azanium Openeye Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(7-methoxy-2-oxo-chromen-4-yl)methyl]ammonium CAS Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(7-methoxy-2-oxo-1-benzopyran-4-yl)methyl]ammonium IUPAC Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(7-methoxy-2-oxochromen-4-yl)methyl]azanium Traditional Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(2-keto-7-methoxy-chromen-4-yl)methyl]ammonium Formula: C20H20NO5+ MolecularWeight: 354.3765

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH2+]CC3COC4=CC=CC=C4O3

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH2+]C[C@H]3COC4=CC=CC=C4O3

InChI

InChI=1S/C20H19NO5/c1-23-14-6-7-16-13(8-20(22)26-19(16)9-14)10-21-11-15-12-24-17-4-2-3-5-18(17)25-15/h2-9,15,21H,10-12H2,1H3/p+1/t15-/m0/s1