[4-[2-(6-oxidanylhexylamino)-2-oxidanylidene-ethyl]-2-oxidanylidene-chromen-7-yl] 2,2-dimethylpropanoate

Systemtic Name: [4-[2-(6-oxidanylhexylamino)-2-oxidanylidene-ethyl]-2-oxidanylidene-chromen-7-yl] 2,2-dimethylpropanoate Openeye Name: [4-[2-(6-hydroxyhexylamino)-2-oxo-ethyl]-2-oxo-chromen-7-yl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [4-[2-(6-hydroxyhexylamino)-2-oxoethyl]-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [4-[2-(6-hydroxyhexylamino)-2-oxoethyl]-2-oxochromen-7-yl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [4-[2-(6-hydroxyhexylamino)-2-keto-ethyl]-2-keto-chromen-7-yl] ester Formula: C22H29NO6 MolecularWeight: 403.46876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1=CC2=C(C=C1)C(=CC(=O)O2)CC(=O)NCCCCCCO

Isomeric SMILES

CC(C)(C)C(=O)OC1=CC2=C(C=C1)C(=CC(=O)O2)CC(=O)NCCCCCCO

InChI

InChI=1S/C22H29NO6/c1-22(2,3)21(27)28-16-8-9-17-15(13-20(26)29-18(17)14-16)12-19(25)23-10-6-4-5-7-11-24/h8-9,13-14,24H,4-7,10-12H2,1-3H3,(H,23,25)