2-[2-(3-methoxy-4-oxidanyl-phenyl)-6,8-dimethyl-chromen-4-ylidene]azaniumylethanoate

Systemtic Name: 2-[2-(3-methoxy-4-oxidanyl-phenyl)-6,8-dimethyl-chromen-4-ylidene]azaniumylethanoate Openeye Name: 2-[2-(4-hydroxy-3-methoxy-phenyl)-6,8-dimethyl-chromen-4-ylidene]ammonioacetate CAS Name: 2-[[2-(4-hydroxy-3-methoxyphenyl)-6,8-dimethyl-1-benzopyran-4-ylidene]ammonio]acetate IUPAC Name: 2-[2-(4-hydroxy-3-methoxyphenyl)-6,8-dimethylchromen-4-ylidene]azaniumylacetate Traditional Name: 2-[2-(4-hydroxy-3-methoxy-phenyl)-6,8-dimethyl-chromen-4-ylidene]ammonioacetate Formula: C20H19NO5 MolecularWeight: 353.36856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=[NH+]CC(=O)[O-])C=C(O2)C3=CC(=C(C=C3)O)OC)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=[NH+]CC(=O)[O-])C=C(O2)C3=CC(=C(C=C3)O)OC)C

InChI

InChI=1S/C20H19NO5/c1-11-6-12(2)20-14(7-11)15(21-10-19(23)24)9-17(26-20)13-4-5-16(22)18(8-13)25-3/h4-9,22H,10H2,1-3H3,(H,23,24)