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

Systemtic Name: (2S,3S)-3-methyl-2-[2-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]ethanoylamino]pentanoate Openeye Name: (2S,3S)-3-methyl-2-[[2-[[2-(4-methyl-2-oxo-chromen-7-yl)oxyacetyl]amino]acetyl]amino]pentanoate CAS Name: (2S,3S)-3-methyl-2-[[2-[[2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]-1-oxoethyl]amino]pentanoate IUPAC Name: (2S,3S)-3-methyl-2-[[2-[[2-(4-methyl-2-oxochromen-7-yl)oxyacetyl]amino]acetyl]amino]pentanoate Traditional Name: (2S,3S)-2-[[2-[[2-(2-keto-4-methyl-chromen-7-yl)oxyacetyl]amino]acetyl]amino]-3-methyl-valerate Formula: C20H23N2O7- MolecularWeight: 403.40582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O7/c1-4-11(2)19(20(26)27)22-16(23)9-21-17(24)10-28-13-5-6-14-12(3)7-18(25)29-15(14)8-13/h5-8,11,19H,4,9-10H2,1-3H3,(H,21,24)(H,22,23)(H,26,27)/p-1/t11-,19-/m0/s1