(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-[2-(4-methylphenoxy)ethyl]azanium

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-[2-(4-methylphenoxy)ethyl]azanium Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl-[2-(4-methylphenoxy)ethyl]ammonium CAS Name: (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl-[2-(4-methylphenoxy)ethyl]ammonium IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl-[2-(4-methylphenoxy)ethyl]azanium Traditional Name: (2-keto-6,7-dimethyl-chromen-4-yl)methyl-[2-(4-methylphenoxy)ethyl]ammonium Formula: C21H24NO3+ MolecularWeight: 338.42016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC[NH2+]CC2=CC(=O)OC3=CC(=C(C=C23)C)C

Isomeric SMILES

CC1=CC=C(C=C1)OCC[NH2+]CC2=CC(=O)OC3=CC(=C(C=C23)C)C

InChI

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