2-(4-chloranylphenoxy)ethyl-[(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]azanium

Systemtic Name: 2-(4-chloranylphenoxy)ethyl-[(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]azanium Openeye Name: 2-(4-chlorophenoxy)ethyl-[(6-ethyl-7-hydroxy-2-oxo-chromen-4-yl)methyl]ammonium CAS Name: 2-(4-chlorophenoxy)ethyl-[(6-ethyl-7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl]ammonium IUPAC Name: 2-(4-chlorophenoxy)ethyl-[(6-ethyl-7-hydroxy-2-oxochromen-4-yl)methyl]azanium Traditional Name: 2-(4-chlorophenoxy)ethyl-[(6-ethyl-7-hydroxy-2-keto-chromen-4-yl)methyl]ammonium Formula: C20H21ClNO4+ MolecularWeight: 374.83804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH2+]CCOC3=CC=C(C=C3)Cl)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH2+]CCOC3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C20H20ClNO4/c1-2-13-9-17-14(10-20(24)26-19(17)11-18(13)23)12-22-7-8-25-16-5-3-15(21)4-6-16/h3-6,9-11,22-23H,2,7-8,12H2,1H3/p+1