2-[2-[2-(3-hexyl-4,8-dimethyl-2-oxidanylidene-chromen-7-yl)oxypropanoylamino]ethanoylamino]ethanoic acid

Systemtic Name: 2-[2-[2-(3-hexyl-4,8-dimethyl-2-oxidanylidene-chromen-7-yl)oxypropanoylamino]ethanoylamino]ethanoic acid Openeye Name: 2-[[2-[2-(3-hexyl-4,8-dimethyl-2-oxo-chromen-7-yl)oxypropanoylamino]acetyl]amino]acetic acid CAS Name: 2-[[2-[[2-[(3-hexyl-4,8-dimethyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxopropyl]amino]-1-oxoethyl]amino]acetic acid IUPAC Name: 2-[[2-[2-(3-hexyl-4,8-dimethyl-2-oxochromen-7-yl)oxypropanoylamino]acetyl]amino]acetic acid Traditional Name: 2-[[2-[2-(3-hexyl-2-keto-4,8-dimethyl-chromen-7-yl)oxypropanoylamino]acetyl]amino]acetic acid Formula: C24H32N2O7 MolecularWeight: 460.52008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C2=C(C(=C(C=C2)OC(C)C(=O)NCC(=O)NCC(=O)O)C)OC1=O)C

Isomeric SMILES

CCCCCCC1=C(C2=C(C(=C(C=C2)OC(C)C(=O)NCC(=O)NCC(=O)O)C)OC1=O)C

InChI

InChI=1S/C24H32N2O7/c1-5-6-7-8-9-18-14(2)17-10-11-19(15(3)22(17)33-24(18)31)32-16(4)23(30)26-12-20(27)25-13-21(28)29/h10-11,16H,5-9,12-13H2,1-4H3,(H,25,27)(H,26,30)(H,28,29)