6-[[(2R)-2-(4-butyl-8-methyl-2-oxidanylidene-chromen-7-yl)oxypropanoyl]amino]hexanoic acid

Systemtic Name: 6-[[(2R)-2-(4-butyl-8-methyl-2-oxidanylidene-chromen-7-yl)oxypropanoyl]amino]hexanoic acid Openeye Name: 6-[[(2R)-2-(4-butyl-8-methyl-2-oxo-chromen-7-yl)oxypropanoyl]amino]hexanoic acid CAS Name: 6-[[(2R)-2-[(4-butyl-8-methyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxopropyl]amino]hexanoic acid IUPAC Name: 6-[[(2R)-2-(4-butyl-8-methyl-2-oxochromen-7-yl)oxypropanoyl]amino]hexanoic acid Traditional Name: 6-[[(2R)-2-(4-butyl-2-keto-8-methyl-chromen-7-yl)oxypropanoyl]amino]hexanoic acid Formula: C23H31NO6 MolecularWeight: 417.49534

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C=CC(=C2C)O[C@H](C)C(=O)NCCCCCC(=O)O

InChI

InChI=1S/C23H31NO6/c1-4-5-9-17-14-21(27)30-22-15(2)19(12-11-18(17)22)29-16(3)23(28)24-13-8-6-7-10-20(25)26/h11-12,14,16H,4-10,13H2,1-3H3,(H,24,28)(H,25,26)/t16-/m1/s1