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

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

Systemtic Name:(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl-[(2R)-2-phenylpropyl]azanium
Openeye Name:(6-ethyl-7-hydroxy-2-oxo-chromen-4-yl)methyl-[(2R)-2-phenylpropyl]ammonium
CAS Name:(6-ethyl-7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl-[(2R)-2-phenylpropyl]ammonium
IUPAC Name:(6-ethyl-7-hydroxy-2-oxochromen-4-yl)methyl-[(2R)-2-phenylpropyl]azanium
Traditional Name:(6-ethyl-7-hydroxy-2-keto-chromen-4-yl)methyl-[(2R)-2-phenylpropyl]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[NH2+]CC(C)C3=CC=CC=C3)O


Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH2+]C[C@H](C)C3=CC=CC=C3)O


InChI

InChI=1S/C21H23NO3/c1-3-15-9-18-17(10-21(24)25-20(18)11-19(15)23)13-22-12-14(2)16-7-5-4-6-8-16/h4-11,14,22-23H,3,12-13H2,1-2H3/p+1/t14-/m0/s1


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