methyl 4-chloranyl-2-[2-(4,8-dimethyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]benzoate

Systemtic Name: methyl 4-chloranyl-2-[2-(4,8-dimethyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]benzoate Openeye Name: methyl 4-chloro-2-[[2-(7-hydroxy-4,8-dimethyl-2-oxo-chromen-3-yl)acetyl]amino]benzoate CAS Name: 4-chloro-2-[[2-(7-hydroxy-4,8-dimethyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-2-[[2-(7-hydroxy-4,8-dimethyl-2-oxochromen-3-yl)acetyl]amino]benzoate Traditional Name: 4-chloro-2-[[2-(7-hydroxy-2-keto-4,8-dimethyl-chromen-3-yl)acetyl]amino]benzoic acid methyl ester Formula: C21H18ClNO6 MolecularWeight: 415.82372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)O)CC(=O)NC3=C(C=CC(=C3)Cl)C(=O)OC

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C)O)CC(=O)NC3=C(C=CC(=C3)Cl)C(=O)OC

InChI

InChI=1S/C21H18ClNO6/c1-10-13-6-7-17(24)11(2)19(13)29-21(27)15(10)9-18(25)23-16-8-12(22)4-5-14(16)20(26)28-3/h4-8,24H,9H2,1-3H3,(H,23,25)