(2S)-3-methyl-2-[2-(7-methyl-2-oxidanylidene-4-propyl-chromen-5-yl)oxyethanoylamino]butanoate

Systemtic Name: (2S)-3-methyl-2-[2-(7-methyl-2-oxidanylidene-4-propyl-chromen-5-yl)oxyethanoylamino]butanoate Openeye Name: (2S)-3-methyl-2-[[2-(7-methyl-2-oxo-4-propyl-chromen-5-yl)oxyacetyl]amino]butanoate CAS Name: (2S)-3-methyl-2-[[2-[(7-methyl-2-oxo-4-propyl-1-benzopyran-5-yl)oxy]-1-oxoethyl]amino]butanoate IUPAC Name: (2S)-3-methyl-2-[[2-(7-methyl-2-oxo-4-propylchromen-5-yl)oxyacetyl]amino]butanoate Traditional Name: (2S)-2-[[2-(2-keto-7-methyl-4-propyl-chromen-5-yl)oxyacetyl]amino]-3-methyl-butyrate Formula: C20H24NO6- MolecularWeight: 374.40766

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OCC(=O)NC(C(C)C)C(=O)[O-]

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OCC(=O)N[C@@H](C(C)C)C(=O)[O-]

InChI

InChI=1S/C20H25NO6/c1-5-6-13-9-17(23)27-15-8-12(4)7-14(18(13)15)26-10-16(22)21-19(11(2)3)20(24)25/h7-9,11,19H,5-6,10H2,1-4H3,(H,21,22)(H,24,25)/p-1/t19-/m0/s1