tert-butyl N-(3-fluoranyl-4-piperazin-1-yl-phenyl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate

Systemtic Name: tert-butyl N-(3-fluoranyl-4-piperazin-1-yl-phenyl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate Openeye Name: tert-butyl N-tert-butoxycarbonyl-N-(3-fluoro-4-piperazin-1-yl-phenyl)carbamate CAS Name: N-[3-fluoro-4-(1-piperazinyl)phenyl]-N-[(2-methylpropan-2-yl)oxy-oxomethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(3-fluoro-4-piperazin-1-ylphenyl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate Traditional Name: N-tert-butoxycarbonyl-N-(3-fluoro-4-piperazino-phenyl)carbamic acid tert-butyl ester Formula: C20H30FN3O4 MolecularWeight: 395.468303

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C1=CC(=C(C=C1)N2CCNCC2)F)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N(C1=CC(=C(C=C1)N2CCNCC2)F)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H30FN3O4/c1-19(2,3)27-17(25)24(18(26)28-20(4,5)6)14-7-8-16(15(21)13-14)23-11-9-22-10-12-23/h7-8,13,22H,9-12H2,1-6H3