tert-butyl 4-[4-[4-(aminomethyl)-1,2,3-triazol-1-yl]-2,6-bis(fluoranyl)phenyl]-3,6-dihydro-2H-pyridine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[4-(aminomethyl)-1,2,3-triazol-1-yl]-2,6-bis(fluoranyl)phenyl]-3,6-dihydro-2H-pyridine-1-carboxylate Openeye Name: tert-butyl 4-[4-[4-(aminomethyl)triazol-1-yl]-2,6-difluoro-phenyl]-3,6-dihydro-2H-pyridine-1-carboxylate CAS Name: 4-[4-[4-(aminomethyl)-1-triazolyl]-2,6-difluorophenyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[4-(aminomethyl)triazol-1-yl]-2,6-difluorophenyl]-3,6-dihydro-2H-pyridine-1-carboxylate Traditional Name: 4-[4-[4-(aminomethyl)triazol-1-yl]-2,6-difluoro-phenyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester Formula: C19H23F2N5O2 MolecularWeight: 391.415026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(=CC1)C2=C(C=C(C=C2F)N3C=C(N=N3)CN)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(=CC1)C2=C(C=C(C=C2F)N3C=C(N=N3)CN)F

InChI

InChI=1S/C19H23F2N5O2/c1-19(2,3)28-18(27)25-6-4-12(5-7-25)17-15(20)8-14(9-16(17)21)26-11-13(10-22)23-24-26/h4,8-9,11H,5-7,10,22H2,1-3H3