(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl-[(R)-phenyl(thiophen-2-yl)methyl]azanium

Systemtic Name: (7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl-[(R)-phenyl(thiophen-2-yl)methyl]azanium Openeye Name: (7-hydroxy-2-oxo-chromen-4-yl)methyl-[(R)-phenyl(2-thienyl)methyl]ammonium CAS Name: (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl-[(R)-phenyl(thiophen-2-yl)methyl]ammonium IUPAC Name: (7-hydroxy-2-oxochromen-4-yl)methyl-[(R)-phenyl(thiophen-2-yl)methyl]azanium Traditional Name: (7-hydroxy-2-keto-chromen-4-yl)methyl-[(R)-phenyl(2-thienyl)methyl]ammonium Formula: C21H18NO3S+ MolecularWeight: 364.43752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CS2)[NH2+]CC3=CC(=O)OC4=C3C=CC(=C4)O

Isomeric SMILES

C1=CC=C(C=C1)[C@H](C2=CC=CS2)[NH2+]CC3=CC(=O)OC4=C3C=CC(=C4)O

InChI

InChI=1S/C21H17NO3S/c23-16-8-9-17-15(11-20(24)25-18(17)12-16)13-22-21(19-7-4-10-26-19)14-5-2-1-3-6-14/h1-12,21-23H,13H2/p+1/t21-/m1/s1