3-[(6-bromanyl-8-methoxy-2-oxidanylidene-chromen-3-yl)carbonylamino]propyl-diethyl-azanium

Systemtic Name: 3-[(6-bromanyl-8-methoxy-2-oxidanylidene-chromen-3-yl)carbonylamino]propyl-diethyl-azanium Openeye Name: 3-[(6-bromo-8-methoxy-2-oxo-chromene-3-carbonyl)amino]propyl-diethyl-ammonium CAS Name: 3-[[(6-bromo-8-methoxy-2-oxo-1-benzopyran-3-yl)-oxomethyl]amino]propyl-diethylammonium IUPAC Name: 3-[(6-bromo-8-methoxy-2-oxochromene-3-carbonyl)amino]propyl-diethylazanium Traditional Name: 3-[(6-bromo-2-keto-8-methoxy-chromene-3-carbonyl)amino]propyl-diethyl-ammonium Formula: C18H24BrN2O4+ MolecularWeight: 412.29816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC(=O)C1=CC2=CC(=CC(=C2OC1=O)OC)Br

Isomeric SMILES

CC[NH+](CC)CCCNC(=O)C1=CC2=CC(=CC(=C2OC1=O)OC)Br

InChI

InChI=1S/C18H23BrN2O4/c1-4-21(5-2)8-6-7-20-17(22)14-10-12-9-13(19)11-15(24-3)16(12)25-18(14)23/h9-11H,4-8H2,1-3H3,(H,20,22)/p+1