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

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-[(1S)-2-methyl-1-phenyl-propyl]azanium Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl-[(1S)-2-methyl-1-phenyl-propyl]ammonium CAS Name: (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl-[(1S)-2-methyl-1-phenylpropyl]ammonium IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl-[(1S)-2-methyl-1-phenylpropyl]azanium Traditional Name: (2-keto-7,8-dimethyl-chromen-4-yl)methyl-[(1S)-2-methyl-1-phenyl-propyl]ammonium Formula: C22H26NO2+ MolecularWeight: 336.44734

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25NO2/c1-14(2)21(17-8-6-5-7-9-17)23-13-18-12-20(24)25-22-16(4)15(3)10-11-19(18)22/h5-12,14,21,23H,13H2,1-4H3/p+1/t21-/m0/s1