3-methyl-2-[2-[2-(8-methyl-2-oxidanylidene-4-propyl-chromen-7-yl)oxyethanoylamino]ethanoylamino]butanoic acid

Systemtic Name: 3-methyl-2-[2-[2-(8-methyl-2-oxidanylidene-4-propyl-chromen-7-yl)oxyethanoylamino]ethanoylamino]butanoic acid Openeye Name: 3-methyl-2-[[2-[[2-(8-methyl-2-oxo-4-propyl-chromen-7-yl)oxyacetyl]amino]acetyl]amino]butanoic acid CAS Name: 3-methyl-2-[[2-[[2-[(8-methyl-2-oxo-4-propyl-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]-1-oxoethyl]amino]butanoic acid IUPAC Name: 3-methyl-2-[[2-[[2-(8-methyl-2-oxo-4-propylchromen-7-yl)oxyacetyl]amino]acetyl]amino]butanoic acid Traditional Name: 2-[[2-[[2-(2-keto-8-methyl-4-propyl-chromen-7-yl)oxyacetyl]amino]acetyl]amino]-3-methyl-butyric acid Formula: C22H28N2O7 MolecularWeight: 432.46692

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C=CC(=C2C)OCC(=O)NCC(=O)NC(C(C)C)C(=O)O

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C=CC(=C2C)OCC(=O)NCC(=O)NC(C(C)C)C(=O)O

InChI

InChI=1S/C22H28N2O7/c1-5-6-14-9-19(27)31-21-13(4)16(8-7-15(14)21)30-11-18(26)23-10-17(25)24-20(12(2)3)22(28)29/h7-9,12,20H,5-6,10-11H2,1-4H3,(H,23,26)(H,24,25)(H,28,29)