3-(4-fluorophenyl)-8-[[[(2R)-1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl]amino]methyl]-7-oxidanyl-4-oxidanylidene-chromene-2-carboxylic acid

Systemtic Name: 3-(4-fluorophenyl)-8-[[[(2R)-1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl]amino]methyl]-7-oxidanyl-4-oxidanylidene-chromene-2-carboxylic acid Openeye Name: 8-[[[(1R)-1-benzyl-2-methoxy-2-oxo-ethyl]amino]methyl]-3-(4-fluorophenyl)-7-hydroxy-4-oxo-chromene-2-carboxylic acid CAS Name: 3-(4-fluorophenyl)-7-hydroxy-8-[[[(2R)-1-methoxy-1-oxo-3-phenylpropan-2-yl]amino]methyl]-4-oxo-1-benzopyran-2-carboxylic acid IUPAC Name: 3-(4-fluorophenyl)-7-hydroxy-8-[[[(2R)-1-methoxy-1-oxo-3-phenylpropan-2-yl]amino]methyl]-4-oxochromene-2-carboxylic acid Traditional Name: 8-[[[(1R)-1-benzyl-2-keto-2-methoxy-ethyl]amino]methyl]-3-(4-fluorophenyl)-7-hydroxy-4-keto-chromene-2-carboxylic acid Formula: C27H22FNO7 MolecularWeight: 491.464483

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NCC2=C(C=CC3=C2OC(=C(C3=O)C4=CC=C(C=C4)F)C(=O)O)O

Isomeric SMILES

COC(=O)[C@@H](CC1=CC=CC=C1)NCC2=C(C=CC3=C2OC(=C(C3=O)C4=CC=C(C=C4)F)C(=O)O)O

InChI

InChI=1S/C27H22FNO7/c1-35-27(34)20(13-15-5-3-2-4-6-15)29-14-19-21(30)12-11-18-23(31)22(16-7-9-17(28)10-8-16)25(26(32)33)36-24(18)19/h2-12,20,29-30H,13-14H2,1H3,(H,32,33)/t20-/m1/s1