(E)-3-(8-chloranyl-7-methoxy-2,2-dimethyl-4-propan-2-yl-chromen-6-yl)-2-fluoranyl-but-2-enoic acid

Systemtic Name: (E)-3-(8-chloranyl-7-methoxy-2,2-dimethyl-4-propan-2-yl-chromen-6-yl)-2-fluoranyl-but-2-enoic acid Openeye Name: (E)-3-(8-chloro-4-isopropyl-7-methoxy-2,2-dimethyl-chromen-6-yl)-2-fluoro-but-2-enoic acid CAS Name: (E)-3-(8-chloro-7-methoxy-2,2-dimethyl-4-propan-2-yl-1-benzopyran-6-yl)-2-fluoro-2-butenoic acid IUPAC Name: (E)-3-(8-chloro-7-methoxy-2,2-dimethyl-4-propan-2-ylchromen-6-yl)-2-fluorobut-2-enoic acid Traditional Name: (E)-3-(8-chloro-4-isopropyl-7-methoxy-2,2-dimethyl-chromen-6-yl)-2-fluoro-but-2-enoic acid Formula: C19H22ClFO4 MolecularWeight: 368.826983

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(OC2=C(C(=C(C=C12)C(=C(C(=O)O)F)C)OC)Cl)(C)C

Isomeric SMILES

CC(C)C1=CC(OC2=C(C(=C(C=C12)/C(=C(\C(=O)O)/F)/C)OC)Cl)(C)C

InChI

InChI=1S/C19H22ClFO4/c1-9(2)13-8-19(4,5)25-17-12(13)7-11(16(24-6)14(17)20)10(3)15(21)18(22)23/h7-9H,1-6H3,(H,22,23)/b15-10+