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

Systemtic Name: (6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl-[(2-methoxyphenyl)methyl]azanium Openeye Name: (6-ethyl-7-hydroxy-2-oxo-chromen-4-yl)methyl-[(2-methoxyphenyl)methyl]ammonium CAS Name: (6-ethyl-7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl-[(2-methoxyphenyl)methyl]ammonium IUPAC Name: (6-ethyl-7-hydroxy-2-oxochromen-4-yl)methyl-[(2-methoxyphenyl)methyl]azanium Traditional Name: (6-ethyl-7-hydroxy-2-keto-chromen-4-yl)methyl-o-anisyl-ammonium Formula: C20H22NO4+ MolecularWeight: 340.39298

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH2+]CC3=CC=CC=C3OC)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH2+]CC3=CC=CC=C3OC)O

InChI

InChI=1S/C20H21NO4/c1-3-13-8-16-15(9-20(23)25-19(16)10-17(13)22)12-21-11-14-6-4-5-7-18(14)24-2/h4-10,21-22H,3,11-12H2,1-2H3/p+1