(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl-(2-phenoxyethyl)azanium

Systemtic Name: (8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl-(2-phenoxyethyl)azanium Openeye Name: (7-hydroxy-8-methyl-2-oxo-chromen-4-yl)methyl-(2-phenoxyethyl)ammonium CAS Name: (7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)methyl-(2-phenoxyethyl)ammonium IUPAC Name: (7-hydroxy-8-methyl-2-oxochromen-4-yl)methyl-(2-phenoxyethyl)azanium Traditional Name: (7-hydroxy-2-keto-8-methyl-chromen-4-yl)methyl-(2-phenoxyethyl)ammonium Formula: C19H20NO4+ MolecularWeight: 326.3664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2C[NH2+]CCOC3=CC=CC=C3)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2C[NH2+]CCOC3=CC=CC=C3)O

InChI

InChI=1S/C19H19NO4/c1-13-17(21)8-7-16-14(11-18(22)24-19(13)16)12-20-9-10-23-15-5-3-2-4-6-15/h2-8,11,20-21H,9-10,12H2,1H3/p+1