3-methyl-2-[2-(7-oxidanyl-2-oxidanylidene-chromen-4-yl)ethanoylamino]butanoic acid

Systemtic Name: 3-methyl-2-[2-(7-oxidanyl-2-oxidanylidene-chromen-4-yl)ethanoylamino]butanoic acid Openeye Name: 2-[[2-(7-hydroxy-2-oxo-chromen-4-yl)acetyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-(7-hydroxy-2-oxo-1-benzopyran-4-yl)-1-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-(7-hydroxy-2-oxochromen-4-yl)acetyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-(7-hydroxy-2-keto-chromen-4-yl)acetyl]amino]-3-methyl-butyric acid Formula: C16H17NO6 MolecularWeight: 319.30928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)CC1=CC(=O)OC2=C1C=CC(=C2)O

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)CC1=CC(=O)OC2=C1C=CC(=C2)O

InChI

InChI=1S/C16H17NO6/c1-8(2)15(16(21)22)17-13(19)5-9-6-14(20)23-12-7-10(18)3-4-11(9)12/h3-4,6-8,15,18H,5H2,1-2H3,(H,17,19)(H,21,22)