(2S)-2-[2-(4-ethyl-2-oxidanylidene-chromen-7-yl)oxypropanoylamino]-3-methyl-butanoic acid

Systemtic Name: (2S)-2-[2-(4-ethyl-2-oxidanylidene-chromen-7-yl)oxypropanoylamino]-3-methyl-butanoic acid Openeye Name: (2S)-2-[2-(4-ethyl-2-oxo-chromen-7-yl)oxypropanoylamino]-3-methyl-butanoic acid CAS Name: (2S)-2-[[2-[(4-ethyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxopropyl]amino]-3-methylbutanoic acid IUPAC Name: (2S)-2-[2-(4-ethyl-2-oxochromen-7-yl)oxypropanoylamino]-3-methylbutanoic acid Traditional Name: (2S)-2-[2-(4-ethyl-2-keto-chromen-7-yl)oxypropanoylamino]-3-methyl-butyric acid Formula: C19H23NO6 MolecularWeight: 361.38902

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C1C=CC(=C2)OC(C)C(=O)NC(C(C)C)C(=O)O

Isomeric SMILES

CCC1=CC(=O)OC2=C1C=CC(=C2)OC(C)C(=O)N[C@@H](C(C)C)C(=O)O

InChI

InChI=1S/C19H23NO6/c1-5-12-8-16(21)26-15-9-13(6-7-14(12)15)25-11(4)18(22)20-17(10(2)3)19(23)24/h6-11,17H,5H2,1-4H3,(H,20,22)(H,23,24)/t11?,17-/m0/s1