2-tert-butyl-4-[[2-[(4-fluorophenyl)methyl]-3-methyl-phenyl]amino]piperidine-1-carboxylate

Systemtic Name: 2-tert-butyl-4-[[2-[(4-fluorophenyl)methyl]-3-methyl-phenyl]amino]piperidine-1-carboxylate Openeye Name: 2-tert-butyl-4-[2-[(4-fluorophenyl)methyl]-3-methyl-anilino]piperidine-1-carboxylate CAS Name: 2-tert-butyl-4-[2-[(4-fluorophenyl)methyl]-3-methylanilino]-1-piperidinecarboxylate IUPAC Name: 2-tert-butyl-4-[2-[(4-fluorophenyl)methyl]-3-methylanilino]piperidine-1-carboxylate Traditional Name: 2-tert-butyl-4-[2-(4-fluorobenzyl)-3-methyl-anilino]piperidine-1-carboxylate Formula: C24H30FN2O2- MolecularWeight: 397.505603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC2CCN(C(C2)C(C)(C)C)C(=O)[O-])CC3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(C(=CC=C1)NC2CCN(C(C2)C(C)(C)C)C(=O)[O-])CC3=CC=C(C=C3)F

InChI

InChI=1S/C24H31FN2O2/c1-16-6-5-7-21(20(16)14-17-8-10-18(25)11-9-17)26-19-12-13-27(23(28)29)22(15-19)24(2,3)4/h5-11,19,22,26H,12-15H2,1-4H3,(H,28,29)/p-1