6-[[(3,4-dimethoxyphenyl)azaniumyl]methyl]-3-(2-methoxy-2-oxidanylidene-ethyl)-4,8-dimethyl-2-oxidanylidene-chromen-7-olate

Systemtic Name: 6-[[(3,4-dimethoxyphenyl)azaniumyl]methyl]-3-(2-methoxy-2-oxidanylidene-ethyl)-4,8-dimethyl-2-oxidanylidene-chromen-7-olate Openeye Name: 6-[[(3,4-dimethoxyphenyl)ammonio]methyl]-3-(2-methoxy-2-oxo-ethyl)-4,8-dimethyl-2-oxo-chromen-7-olate CAS Name: 6-[[(3,4-dimethoxyphenyl)ammonio]methyl]-3-(2-methoxy-2-oxoethyl)-4,8-dimethyl-2-oxo-1-benzopyran-7-olate IUPAC Name: 6-[[(3,4-dimethoxyphenyl)azaniumyl]methyl]-3-(2-methoxy-2-oxoethyl)-4,8-dimethyl-2-oxochromen-7-olate Traditional Name: 6-[[(3,4-dimethoxyphenyl)ammonio]methyl]-2-keto-3-(2-keto-2-methoxy-ethyl)-4,8-dimethyl-chromen-7-olate Formula: C23H25NO7 MolecularWeight: 427.4471

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C(C(=C(C=C12)C[NH2+]C3=CC(=C(C=C3)OC)OC)[O-])C)CC(=O)OC

Isomeric SMILES

CC1=C(C(=O)OC2=C(C(=C(C=C12)C[NH2+]C3=CC(=C(C=C3)OC)OC)[O-])C)CC(=O)OC

InChI

InChI=1S/C23H25NO7/c1-12-16-8-14(11-24-15-6-7-18(28-3)19(9-15)29-4)21(26)13(2)22(16)31-23(27)17(12)10-20(25)30-5/h6-9,24,26H,10-11H2,1-5H3