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

Systemtic Name: (2S)-2-[2-(5,7-dimethoxy-4-methyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]-3-methyl-butanoate Openeye Name: (2S)-2-[[2-(5,7-dimethoxy-4-methyl-2-oxo-chromen-3-yl)acetyl]amino]-3-methyl-butanoate CAS Name: (2S)-2-[[2-(5,7-dimethoxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]amino]-3-methylbutanoate IUPAC Name: (2S)-2-[[2-(5,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-3-methylbutanoate Traditional Name: (2S)-2-[[2-(2-keto-5,7-dimethoxy-4-methyl-chromen-3-yl)acetyl]amino]-3-methyl-butyrate Formula: C19H22NO7- MolecularWeight: 376.38048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=CC(=C12)OC)OC)CC(=O)NC(C(C)C)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=CC(=C12)OC)OC)CC(=O)N[C@@H](C(C)C)C(=O)[O-]

InChI

InChI=1S/C19H23NO7/c1-9(2)17(18(22)23)20-15(21)8-12-10(3)16-13(26-5)6-11(25-4)7-14(16)27-19(12)24/h6-7,9,17H,8H2,1-5H3,(H,20,21)(H,22,23)/p-1/t17-/m0/s1