dimethyl-[(1S)-2-[(7-methyl-4-oxidanylidene-chromen-2-yl)carbonylamino]-1-(4-methylphenyl)ethyl]azanium

Systemtic Name: dimethyl-[(1S)-2-[(7-methyl-4-oxidanylidene-chromen-2-yl)carbonylamino]-1-(4-methylphenyl)ethyl]azanium Openeye Name: dimethyl-[(1S)-2-[(7-methyl-4-oxo-chromene-2-carbonyl)amino]-1-(p-tolyl)ethyl]ammonium CAS Name: dimethyl-[(1S)-2-[[(7-methyl-4-oxo-1-benzopyran-2-yl)-oxomethyl]amino]-1-(4-methylphenyl)ethyl]ammonium IUPAC Name: dimethyl-[(1S)-2-[(7-methyl-4-oxochromene-2-carbonyl)amino]-1-(4-methylphenyl)ethyl]azanium Traditional Name: [(1S)-2-[(4-keto-7-methyl-chromene-2-carbonyl)amino]-1-(p-tolyl)ethyl]-dimethyl-ammonium Formula: C22H25N2O3+ MolecularWeight: 365.4455

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2O3/c1-14-5-8-16(9-6-14)18(24(3)4)13-23-22(26)21-12-19(25)17-10-7-15(2)11-20(17)27-21/h5-12,18H,13H2,1-4H3,(H,23,26)/p+1/t18-/m1/s1