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

Systemtic Name: (2S)-2-[2-(2-oxidanylidene-4-propyl-chromen-7-yl)oxyethanoylamino]butanedioate Openeye Name: (2S)-2-[[2-(2-oxo-4-propyl-chromen-7-yl)oxyacetyl]amino]butanedioate CAS Name: (2S)-2-[[1-oxo-2-[(2-oxo-4-propyl-1-benzopyran-7-yl)oxy]ethyl]amino]butanedioate IUPAC Name: (2S)-2-[[2-(2-oxo-4-propylchromen-7-yl)oxyacetyl]amino]butanedioate Traditional Name: (2S)-2-[[2-(2-keto-4-propyl-chromen-7-yl)oxyacetyl]amino]succinate Formula: C18H17NO8-2 MolecularWeight: 375.32948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19NO8/c1-2-3-10-6-17(23)27-14-7-11(4-5-12(10)14)26-9-15(20)19-13(18(24)25)8-16(21)22/h4-7,13H,2-3,8-9H2,1H3,(H,19,20)(H,21,22)(H,24,25)/p-2/t13-/m0/s1