[2-[[3-(4,7-dimethyl-2-oxidanylidene-chromen-3-yl)propanoylamino]methyl]phenyl]methyl-dimethyl-azanium

Systemtic Name: [2-[[3-(4,7-dimethyl-2-oxidanylidene-chromen-3-yl)propanoylamino]methyl]phenyl]methyl-dimethyl-azanium Openeye Name: [2-[[3-(4,7-dimethyl-2-oxo-chromen-3-yl)propanoylamino]methyl]phenyl]methyl-dimethyl-ammonium CAS Name: [2-[[[3-(4,7-dimethyl-2-oxo-1-benzopyran-3-yl)-1-oxopropyl]amino]methyl]phenyl]methyl-dimethylammonium IUPAC Name: [2-[[3-(4,7-dimethyl-2-oxochromen-3-yl)propanoylamino]methyl]phenyl]methyl-dimethylazanium Traditional Name: [2-[[3-(2-keto-4,7-dimethyl-chromen-3-yl)propanoylamino]methyl]benzyl]-dimethyl-ammonium Formula: C24H29N2O3+ MolecularWeight: 393.49866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(C(=O)O2)CCC(=O)NCC3=CC=CC=C3C[NH+](C)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(C(=O)O2)CCC(=O)NCC3=CC=CC=C3C[NH+](C)C)C

InChI

InChI=1S/C24H28N2O3/c1-16-9-10-20-17(2)21(24(28)29-22(20)13-16)11-12-23(27)25-14-18-7-5-6-8-19(18)15-26(3)4/h5-10,13H,11-12,14-15H2,1-4H3,(H,25,27)/p+1