3-[(5-methoxy-4-oxidanylidene-chromen-2-yl)carbonylamino]propyl-trimethyl-azanium iodide

Systemtic Name: 3-[(5-methoxy-4-oxidanylidene-chromen-2-yl)carbonylamino]propyl-trimethyl-azanium iodide Openeye Name: 3-[(5-methoxy-4-oxo-chromene-2-carbonyl)amino]propyl-trimethyl-ammonium iodide CAS Name: 3-[[(5-methoxy-4-oxo-1-benzopyran-2-yl)-oxomethyl]amino]propyl-trimethylammonium iodide IUPAC Name: 3-[(5-methoxy-4-oxochromene-2-carbonyl)amino]propyl-trimethylazanium iodide Traditional Name: 3-[(4-keto-5-methoxy-chromene-2-carbonyl)amino]propyl-trimethyl-ammonium iodide Formula: C17H23IN2O4 MolecularWeight: 446.27999

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCCNC(=O)C1=CC(=O)C2=C(O1)C=CC=C2OC.[I-]

Isomeric SMILES

C[N+](C)(C)CCCNC(=O)C1=CC(=O)C2=C(O1)C=CC=C2OC.[I-]

InChI

InChI=1S/C17H22N2O4.HI/c1-19(2,3)10-6-9-18-17(21)15-11-12(20)16-13(22-4)7-5-8-14(16)23-15;/h5,7-8,11H,6,9-10H2,1-4H3;1H