methyl 4-[2-[4-methyl-5,7-bis(oxidanyl)-2-oxidanylidene-chromen-3-yl]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[4-methyl-5,7-bis(oxidanyl)-2-oxidanylidene-chromen-3-yl]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-(5,7-dihydroxy-4-methyl-2-oxo-chromen-3-yl)acetyl]amino]benzoate CAS Name: 4-[[2-(5,7-dihydroxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(5,7-dihydroxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(5,7-dihydroxy-2-keto-4-methyl-chromen-3-yl)acetyl]amino]benzoic acid methyl ester Formula: C20H17NO7 MolecularWeight: 383.35148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=CC(=C12)O)O)CC(=O)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=CC(=C12)O)O)CC(=O)NC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H17NO7/c1-10-14(20(26)28-16-8-13(22)7-15(23)18(10)16)9-17(24)21-12-5-3-11(4-6-12)19(25)27-2/h3-8,22-23H,9H2,1-2H3,(H,21,24)