4-[2-(4-butyl-8-methyl-2-oxidanylidene-chromen-7-yl)oxypropanoylamino]butanoic acid

Systemtic Name: 4-[2-(4-butyl-8-methyl-2-oxidanylidene-chromen-7-yl)oxypropanoylamino]butanoic acid Openeye Name: 4-[2-(4-butyl-8-methyl-2-oxo-chromen-7-yl)oxypropanoylamino]butanoic acid CAS Name: 4-[[2-[(4-butyl-8-methyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxopropyl]amino]butanoic acid IUPAC Name: 4-[2-(4-butyl-8-methyl-2-oxochromen-7-yl)oxypropanoylamino]butanoic acid Traditional Name: 4-[2-(4-butyl-2-keto-8-methyl-chromen-7-yl)oxypropanoylamino]butyric acid Formula: C21H27NO6 MolecularWeight: 389.44218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C=CC(=C2C)OC(C)C(=O)NCCCC(=O)O

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C=CC(=C2C)OC(C)C(=O)NCCCC(=O)O

InChI

InChI=1S/C21H27NO6/c1-4-5-7-15-12-19(25)28-20-13(2)17(10-9-16(15)20)27-14(3)21(26)22-11-6-8-18(23)24/h9-10,12,14H,4-8,11H2,1-3H3,(H,22,26)(H,23,24)