3-[[(2R)-2-(4-ethyl-7-methyl-2-oxidanylidene-chromen-5-yl)oxypropanoyl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(2R)-2-(4-ethyl-7-methyl-2-oxidanylidene-chromen-5-yl)oxypropanoyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[(2R)-2-(4-ethyl-7-methyl-2-oxo-chromen-5-yl)oxypropanoyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[(2R)-2-[(4-ethyl-7-methyl-2-oxo-1-benzopyran-5-yl)oxy]-1-oxopropyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(2R)-2-(4-ethyl-7-methyl-2-oxochromen-5-yl)oxypropanoyl]amino]propyl-dimethylazanium Traditional Name: 3-[[(2R)-2-(4-ethyl-2-keto-7-methyl-chromen-5-yl)oxypropanoyl]amino]propyl-dimethyl-ammonium Formula: C20H29N2O4+ MolecularWeight: 361.45526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(C)C(=O)NCCC[NH+](C)C

Isomeric SMILES

CCC1=CC(=O)OC2=C1C(=CC(=C2)C)O[C@H](C)C(=O)NCCC[NH+](C)C

InChI

InChI=1S/C20H28N2O4/c1-6-15-12-18(23)26-17-11-13(2)10-16(19(15)17)25-14(3)20(24)21-8-7-9-22(4)5/h10-12,14H,6-9H2,1-5H3,(H,21,24)/p+1/t14-/m1/s1