(2S,3S)-2-[2-[2-(4-ethyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]ethanoylamino]-3-methyl-pentanoate

Systemtic Name: (2S,3S)-2-[2-[2-(4-ethyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]ethanoylamino]-3-methyl-pentanoate Openeye Name: (2S,3S)-2-[[2-[[2-(4-ethyl-2-oxo-chromen-7-yl)oxyacetyl]amino]acetyl]amino]-3-methyl-pentanoate CAS Name: (2S,3S)-2-[[2-[[2-[(4-ethyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]-1-oxoethyl]amino]-3-methylpentanoate IUPAC Name: (2S,3S)-2-[[2-[[2-(4-ethyl-2-oxochromen-7-yl)oxyacetyl]amino]acetyl]amino]-3-methylpentanoate Traditional Name: (2S,3S)-2-[[2-[[2-(4-ethyl-2-keto-chromen-7-yl)oxyacetyl]amino]acetyl]amino]-3-methyl-valerate Formula: C21H25N2O7- MolecularWeight: 417.4324

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NCC(=O)NC(C(C)CC)C(=O)[O-]

Isomeric SMILES

CCC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NCC(=O)N[C@@H]([C@@H](C)CC)C(=O)[O-]

InChI

InChI=1S/C21H26N2O7/c1-4-12(3)20(21(27)28)23-17(24)10-22-18(25)11-29-14-6-7-15-13(5-2)8-19(26)30-16(15)9-14/h6-9,12,20H,4-5,10-11H2,1-3H3,(H,22,25)(H,23,24)(H,27,28)/p-1/t12-,20-/m0/s1