methyl-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]-[(4-propan-2-ylphenyl)methyl]azanium

Systemtic Name: methyl-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]-[(4-propan-2-ylphenyl)methyl]azanium Openeye Name: (7-hydroxy-2-oxo-chromen-4-yl)methyl-[(4-isopropylphenyl)methyl]-methyl-ammonium CAS Name: (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl-methyl-[(4-propan-2-ylphenyl)methyl]ammonium IUPAC Name: (7-hydroxy-2-oxochromen-4-yl)methyl-methyl-[(4-propan-2-ylphenyl)methyl]azanium Traditional Name: (7-hydroxy-2-keto-chromen-4-yl)methyl-(4-isopropylbenzyl)-methyl-ammonium Formula: C21H24NO3+ MolecularWeight: 338.42016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C[NH+](C)CC2=CC(=O)OC3=C2C=CC(=C3)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C[NH+](C)CC2=CC(=O)OC3=C2C=CC(=C3)O

InChI

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