(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-phenethyl-azanium

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-phenethyl-azanium Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl-phenethyl-ammonium CAS Name: (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl-phenethylammonium IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl-phenethylazanium Traditional Name: (2-keto-7,8-dimethyl-chromen-4-yl)methyl-phenethyl-ammonium Formula: C20H22NO2+ MolecularWeight: 308.39418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)C[NH2+]CCC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)C[NH2+]CCC3=CC=CC=C3)C

InChI

InChI=1S/C20H21NO2/c1-14-8-9-18-17(12-19(22)23-20(18)15(14)2)13-21-11-10-16-6-4-3-5-7-16/h3-9,12,21H,10-11,13H2,1-2H3/p+1