tert-butyl 2-[4-[[[ethyl(2-hydroxyethyl)carbamoyl]-(4-fluorophenyl)amino]methyl]phenyl]cyclohexane-1-carboxylate

Systemtic Name: tert-butyl 2-[4-[[[ethyl(2-hydroxyethyl)carbamoyl]-(4-fluorophenyl)amino]methyl]phenyl]cyclohexane-1-carboxylate Openeye Name: tert-butyl 2-[4-[(N-[ethyl(2-hydroxyethyl)carbamoyl]-4-fluoro-anilino)methyl]phenyl]cyclohexanecarboxylate CAS Name: 2-[4-[(N-[[ethyl(2-hydroxyethyl)amino]-oxomethyl]-4-fluoroanilino)methyl]phenyl]-1-cyclohexanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-[(N-[ethyl(2-hydroxyethyl)carbamoyl]-4-fluoroanilino)methyl]phenyl]cyclohexane-1-carboxylate Traditional Name: 2-[4-[(N-[ethyl(2-hydroxyethyl)carbamoyl]-4-fluoro-anilino)methyl]phenyl]cyclohexanecarboxylic acid tert-butyl ester Formula: C29H39FN2O4 MolecularWeight: 498.629363

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCO)C(=O)N(CC1=CC=C(C=C1)C2CCCCC2C(=O)OC(C)(C)C)C3=CC=C(C=C3)F

Isomeric SMILES

CCN(CCO)C(=O)N(CC1=CC=C(C=C1)C2CCCCC2C(=O)OC(C)(C)C)C3=CC=C(C=C3)F

InChI

InChI=1S/C29H39FN2O4/c1-5-31(18-19-33)28(35)32(24-16-14-23(30)15-17-24)20-21-10-12-22(13-11-21)25-8-6-7-9-26(25)27(34)36-29(2,3)4/h10-17,25-26,33H,5-9,18-20H2,1-4H3