(2S,3S)-3-methyl-2-[2-[2-(2-oxidanylidenechromen-7-yl)oxyethanoylamino]ethanoylamino]-N-propan-2-yl-pentanamide

Systemtic Name: (2S,3S)-3-methyl-2-[2-[2-(2-oxidanylidenechromen-7-yl)oxyethanoylamino]ethanoylamino]-N-propan-2-yl-pentanamide Openeye Name: (2S,3S)-N-isopropyl-3-methyl-2-[[2-[[2-(2-oxochromen-7-yl)oxyacetyl]amino]acetyl]amino]pentanamide CAS Name: (2S,3S)-3-methyl-2-[[1-oxo-2-[[1-oxo-2-[(2-oxo-1-benzopyran-7-yl)oxy]ethyl]amino]ethyl]amino]-N-propan-2-ylpentanamide IUPAC Name: (2S,3S)-3-methyl-2-[[2-[[2-(2-oxochromen-7-yl)oxyacetyl]amino]acetyl]amino]-N-propan-2-ylpentanamide Traditional Name: (2S,3S)-N-isopropyl-2-[[2-[[2-(2-ketochromen-7-yl)oxyacetyl]amino]acetyl]amino]-3-methyl-valeramide Formula: C22H29N3O6 MolecularWeight: 431.48216

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(C)C)NC(=O)CNC(=O)COC1=CC2=C(C=C1)C=CC(=O)O2

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)NC(C)C)NC(=O)CNC(=O)COC1=CC2=C(C=C1)C=CC(=O)O2

InChI

InChI=1S/C22H29N3O6/c1-5-14(4)21(22(29)24-13(2)3)25-18(26)11-23-19(27)12-30-16-8-6-15-7-9-20(28)31-17(15)10-16/h6-10,13-14,21H,5,11-12H2,1-4H3,(H,23,27)(H,24,29)(H,25,26)/t14-,21-/m0/s1