[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl] 2-(2-oxidanylidenechromen-7-yl)oxyethanoate

Systemtic Name: [2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl] 2-(2-oxidanylidenechromen-7-yl)oxyethanoate Openeye Name: [2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxo-ethyl] 2-(2-oxochromen-7-yl)oxyacetate CAS Name: 2-[(2-oxo-1-benzopyran-7-yl)oxy]acetic acid [2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl] 2-(2-oxochromen-7-yl)oxyacetate Traditional Name: 2-(2-ketochromen-7-yl)oxyacetic acid [2-(homoveratrylamino)-2-keto-ethyl] ester Formula: C23H23NO8 MolecularWeight: 441.43062

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)COC(=O)COC2=CC3=C(C=C2)C=CC(=O)O3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)COC(=O)COC2=CC3=C(C=C2)C=CC(=O)O3)OC

InChI

InChI=1S/C23H23NO8/c1-28-18-7-3-15(11-20(18)29-2)9-10-24-21(25)13-31-23(27)14-30-17-6-4-16-5-8-22(26)32-19(16)12-17/h3-8,11-12H,9-10,13-14H2,1-2H3,(H,24,25)