6-[[(2S)-2-(3,4,7-trimethyl-2-oxidanylidene-chromen-5-yl)oxypropanoyl]amino]hexanoate

Systemtic Name: 6-[[(2S)-2-(3,4,7-trimethyl-2-oxidanylidene-chromen-5-yl)oxypropanoyl]amino]hexanoate Openeye Name: 6-[[(2S)-2-(3,4,7-trimethyl-2-oxo-chromen-5-yl)oxypropanoyl]amino]hexanoate CAS Name: 6-[[(2S)-1-oxo-2-[(3,4,7-trimethyl-2-oxo-1-benzopyran-5-yl)oxy]propyl]amino]hexanoate IUPAC Name: 6-[[(2S)-2-(3,4,7-trimethyl-2-oxochromen-5-yl)oxypropanoyl]amino]hexanoate Traditional Name: 6-[[(2S)-2-(2-keto-3,4,7-trimethyl-chromen-5-yl)oxypropanoyl]amino]hexanoate Formula: C21H26NO6- MolecularWeight: 388.43424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(C(=O)O2)C)C)C(=C1)OC(C)C(=O)NCCCCCC(=O)[O-]

Isomeric SMILES

CC1=CC2=C(C(=C(C(=O)O2)C)C)C(=C1)O[C@@H](C)C(=O)NCCCCCC(=O)[O-]

InChI

InChI=1S/C21H27NO6/c1-12-10-16(19-13(2)14(3)21(26)28-17(19)11-12)27-15(4)20(25)22-9-7-5-6-8-18(23)24/h10-11,15H,5-9H2,1-4H3,(H,22,25)(H,23,24)/p-1/t15-/m0/s1