(2S)-4-methyl-2-[2-(2-oxidanylidene-4-propyl-chromen-7-yl)oxyethanoylamino]pentanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25NO6/c1-4-5-13-9-19(23)27-17-10-14(6-7-15(13)17)26-11-18(22)21-16(20(24)25)8-12(2)3/h6-7,9-10,12,16H,4-5,8,11H2,1-3H3,(H,21,22)(H,24,25)/p-1/t16-/m0/s1