2-[2-[2-(6-chloranyl-4-methyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]ethanoylamino]ethanoic acid

Systemtic Name: 2-[2-[2-(6-chloranyl-4-methyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]ethanoylamino]ethanoic acid Openeye Name: 2-[[2-[[2-(6-chloro-7-hydroxy-4-methyl-2-oxo-chromen-3-yl)acetyl]amino]acetyl]amino]acetic acid CAS Name: 2-[[2-[[2-(6-chloro-7-hydroxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]amino]-1-oxoethyl]amino]acetic acid IUPAC Name: 2-[[2-[[2-(6-chloro-7-hydroxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]acetyl]amino]acetic acid Traditional Name: 2-[[2-[[2-(6-chloro-7-hydroxy-2-keto-4-methyl-chromen-3-yl)acetyl]amino]acetyl]amino]acetic acid Formula: C16H15ClN2O7 MolecularWeight: 382.7525

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)O)CC(=O)NCC(=O)NCC(=O)O

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)O)CC(=O)NCC(=O)NCC(=O)O

InChI

InChI=1S/C16H15ClN2O7/c1-7-8-2-10(17)11(20)4-12(8)26-16(25)9(7)3-13(21)18-5-14(22)19-6-15(23)24/h2,4,20H,3,5-6H2,1H3,(H,18,21)(H,19,22)(H,23,24)