(2R)-2-[[(2S)-2-(4-butyl-2-oxidanylidene-chromen-7-yl)oxypropanoyl]amino]hexanoate

Systemtic Name: (2R)-2-[[(2S)-2-(4-butyl-2-oxidanylidene-chromen-7-yl)oxypropanoyl]amino]hexanoate Openeye Name: (2R)-2-[[(2S)-2-(4-butyl-2-oxo-chromen-7-yl)oxypropanoyl]amino]hexanoate CAS Name: (2R)-2-[[(2S)-2-[(4-butyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxopropyl]amino]hexanoate IUPAC Name: (2R)-2-[[(2S)-2-(4-butyl-2-oxochromen-7-yl)oxypropanoyl]amino]hexanoate Traditional Name: (2R)-2-[[(2S)-2-(4-butyl-2-keto-chromen-7-yl)oxypropanoyl]amino]hexanoate Formula: C22H28NO6- MolecularWeight: 402.46082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C=CC(=C2)OC(C)C(=O)NC(CCCC)C(=O)[O-]

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C=CC(=C2)O[C@@H](C)C(=O)N[C@H](CCCC)C(=O)[O-]

InChI

InChI=1S/C22H29NO6/c1-4-6-8-15-12-20(24)29-19-13-16(10-11-17(15)19)28-14(3)21(25)23-18(22(26)27)9-7-5-2/h10-14,18H,4-9H2,1-3H3,(H,23,25)(H,26,27)/p-1/t14-,18+/m0/s1