tert-butyl N-[[3-(2-chloranylpyrimidin-4-yl)phenyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[3-(2-chloranylpyrimidin-4-yl)phenyl]methyl]carbamate Openeye Name: tert-butyl N-[[3-(2-chloropyrimidin-4-yl)phenyl]methyl]carbamate CAS Name: N-[[3-(2-chloro-4-pyrimidinyl)phenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[3-(2-chloropyrimidin-4-yl)phenyl]methyl]carbamate Traditional Name: N-[3-(2-chloropyrimidin-4-yl)benzyl]carbamic acid tert-butyl ester Formula: C16H18ClN3O2 MolecularWeight: 319.78602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC=CC(=C1)C2=NC(=NC=C2)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC=CC(=C1)C2=NC(=NC=C2)Cl

InChI

InChI=1S/C16H18ClN3O2/c1-16(2,3)22-15(21)19-10-11-5-4-6-12(9-11)13-7-8-18-14(17)20-13/h4-9H,10H2,1-3H3,(H,19,21)