(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl-prop-2-enyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: (6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl-prop-2-enyl-(thiophen-2-ylmethyl)azanium Openeye Name: allyl-[(6-ethyl-7-hydroxy-2-oxo-chromen-4-yl)methyl]-(2-thienylmethyl)ammonium CAS Name: (6-ethyl-7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl-prop-2-enyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: (6-ethyl-7-hydroxy-2-oxochromen-4-yl)methyl-prop-2-enyl-(thiophen-2-ylmethyl)azanium Traditional Name: allyl-[(6-ethyl-7-hydroxy-2-keto-chromen-4-yl)methyl]-(2-thenyl)ammonium Formula: C20H22NO3S+ MolecularWeight: 356.45858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH+](CC=C)CC3=CC=CS3)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH+](CC=C)CC3=CC=CS3)O

InChI

InChI=1S/C20H21NO3S/c1-3-7-21(13-16-6-5-8-25-16)12-15-10-20(23)24-19-11-18(22)14(4-2)9-17(15)19/h3,5-6,8-11,22H,1,4,7,12-13H2,2H3/p+1