(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-[(1S)-1-phenylethyl]azanium

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-[(1S)-1-phenylethyl]azanium Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl-[(1S)-1-phenylethyl]ammonium CAS Name: (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl-[(1S)-1-phenylethyl]ammonium IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl-[(1S)-1-phenylethyl]azanium Traditional Name: (2-keto-7,8-dimethyl-chromen-4-yl)methyl-[(1S)-1-phenylethyl]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+]C(C)C3=CC=CC=C3)C

Isomeric SMILES

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

InChI

InChI=1S/C20H21NO2/c1-13-9-10-18-17(11-19(22)23-20(18)14(13)2)12-21-15(3)16-7-5-4-6-8-16/h4-11,15,21H,12H2,1-3H3/p+1/t15-/m0/s1