(2S)-2-[2-[2-(4-ethyl-7-methyl-2-oxidanylidene-chromen-5-yl)oxyethanoylamino]ethanoylamino]-3-methyl-butanoate

Systemtic Name: (2S)-2-[2-[2-(4-ethyl-7-methyl-2-oxidanylidene-chromen-5-yl)oxyethanoylamino]ethanoylamino]-3-methyl-butanoate Openeye Name: (2S)-2-[[2-[[2-(4-ethyl-7-methyl-2-oxo-chromen-5-yl)oxyacetyl]amino]acetyl]amino]-3-methyl-butanoate CAS Name: (2S)-2-[[2-[[2-[(4-ethyl-7-methyl-2-oxo-1-benzopyran-5-yl)oxy]-1-oxoethyl]amino]-1-oxoethyl]amino]-3-methylbutanoate IUPAC Name: (2S)-2-[[2-[[2-(4-ethyl-7-methyl-2-oxochromen-5-yl)oxyacetyl]amino]acetyl]amino]-3-methylbutanoate Traditional Name: (2S)-2-[[2-[[2-(4-ethyl-2-keto-7-methyl-chromen-5-yl)oxyacetyl]amino]acetyl]amino]-3-methyl-butyrate Formula: C21H25N2O7- MolecularWeight: 417.4324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O7/c1-5-13-8-18(26)30-15-7-12(4)6-14(19(13)15)29-10-17(25)22-9-16(24)23-20(11(2)3)21(27)28/h6-8,11,20H,5,9-10H2,1-4H3,(H,22,25)(H,23,24)(H,27,28)/p-1/t20-/m0/s1