(7-ethyl-2-oxidanylidene-chromen-4-yl)methyl-[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl-[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (7-ethyl-2-oxo-chromen-4-yl)methyl-[2-(3-fluoroanilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl-[2-(3-fluoroanilino)-2-oxoethyl]-methylammonium IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl-[2-(3-fluoroanilino)-2-oxoethyl]-methylazanium Traditional Name: (7-ethyl-2-keto-chromen-4-yl)methyl-[2-(3-fluoroanilino)-2-keto-ethyl]-methyl-ammonium Formula: C21H22FN2O3+ MolecularWeight: 369.409383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH+](C)CC(=O)NC3=CC(=CC=C3)F

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH+](C)CC(=O)NC3=CC(=CC=C3)F

InChI

InChI=1S/C21H21FN2O3/c1-3-14-7-8-18-15(10-21(26)27-19(18)9-14)12-24(2)13-20(25)23-17-6-4-5-16(22)11-17/h4-11H,3,12-13H2,1-2H3,(H,23,25)/p+1