tert-butyl N-[4-[4-(4-dimethylaminophenyl)-2,5-dimethoxy-phenyl]-2-fluoranyl-phenyl]carbamate

Systemtic Name: tert-butyl N-[4-[4-(4-dimethylaminophenyl)-2,5-dimethoxy-phenyl]-2-fluoranyl-phenyl]carbamate Openeye Name: tert-butyl N-[4-[4-(4-dimethylaminophenyl)-2,5-dimethoxy-phenyl]-2-fluoro-phenyl]carbamate CAS Name: N-[4-[4-(4-dimethylaminophenyl)-2,5-dimethoxyphenyl]-2-fluorophenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[4-(4-dimethylaminophenyl)-2,5-dimethoxyphenyl]-2-fluorophenyl]carbamate Traditional Name: N-[4-[4-(4-dimethylaminophenyl)-2,5-dimethoxy-phenyl]-2-fluoro-phenyl]carbamic acid tert-butyl ester Formula: C27H31FN2O4 MolecularWeight: 466.544443

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=C(C=C(C=C1)C2=C(C=C(C(=C2)OC)C3=CC=C(C=C3)N(C)C)OC)F

Isomeric SMILES

CC(C)(C)OC(=O)NC1=C(C=C(C=C1)C2=C(C=C(C(=C2)OC)C3=CC=C(C=C3)N(C)C)OC)F

InChI

InChI=1S/C27H31FN2O4/c1-27(2,3)34-26(31)29-23-13-10-18(14-22(23)28)21-16-24(32-6)20(15-25(21)33-7)17-8-11-19(12-9-17)30(4)5/h8-16H,1-7H3,(H,29,31)