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

Systemtic Name: 2-[[(2S)-2-(4-butyl-2-oxidanylidene-chromen-7-yl)oxypropanoyl]amino]ethanoate Openeye Name: 2-[[(2S)-2-(4-butyl-2-oxo-chromen-7-yl)oxypropanoyl]amino]acetate CAS Name: 2-[[(2S)-2-[(4-butyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxopropyl]amino]acetate IUPAC Name: 2-[[(2S)-2-(4-butyl-2-oxochromen-7-yl)oxypropanoyl]amino]acetate Traditional Name: 2-[[(2S)-2-(4-butyl-2-keto-chromen-7-yl)oxypropanoyl]amino]acetate Formula: C18H20NO6- MolecularWeight: 346.3545

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO6/c1-3-4-5-12-8-17(22)25-15-9-13(6-7-14(12)15)24-11(2)18(23)19-10-16(20)21/h6-9,11H,3-5,10H2,1-2H3,(H,19,23)(H,20,21)/p-1/t11-/m0/s1