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

Systemtic Name: dimethyl-[3-[2-(2-methyl-4-oxidanylidene-3-phenyl-chromen-7-yl)oxyethanoylamino]propyl]azanium Openeye Name: dimethyl-[3-[[2-(2-methyl-4-oxo-3-phenyl-chromen-7-yl)oxyacetyl]amino]propyl]ammonium CAS Name: dimethyl-[3-[[2-[(2-methyl-4-oxo-3-phenyl-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]propyl]ammonium IUPAC Name: dimethyl-[3-[[2-(2-methyl-4-oxo-3-phenylchromen-7-yl)oxyacetyl]amino]propyl]azanium Traditional Name: 3-[[2-(4-keto-2-methyl-3-phenyl-chromen-7-yl)oxyacetyl]amino]propyl-dimethyl-ammonium Formula: C23H27N2O4+ MolecularWeight: 395.47148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(=O)NCCC[NH+](C)C)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(=O)NCCC[NH+](C)C)C3=CC=CC=C3

InChI

InChI=1S/C23H26N2O4/c1-16-22(17-8-5-4-6-9-17)23(27)19-11-10-18(14-20(19)29-16)28-15-21(26)24-12-7-13-25(2)3/h4-6,8-11,14H,7,12-13,15H2,1-3H3,(H,24,26)/p+1