tert-butyl N-[(3R,4R)-4-nitro-1-phenyl-pentan-3-yl]carbamate

Systemtic Name: tert-butyl N-[(3R,4R)-4-nitro-1-phenyl-pentan-3-yl]carbamate Openeye Name: tert-butyl N-[(1R,2R)-2-nitro-1-phenethyl-propyl]carbamate CAS Name: N-[(3R,4R)-4-nitro-1-phenylpentan-3-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3R,4R)-4-nitro-1-phenylpentan-3-yl]carbamate Traditional Name: N-[(1R,2R)-2-nitro-1-phenethyl-propyl]carbamic acid tert-butyl ester Formula: C16H24N2O4 MolecularWeight: 308.37276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CCC1=CC=CC=C1)NC(=O)OC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

C[C@H]([C@@H](CCC1=CC=CC=C1)NC(=O)OC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C16H24N2O4/c1-12(18(20)21)14(17-15(19)22-16(2,3)4)11-10-13-8-6-5-7-9-13/h5-9,12,14H,10-11H2,1-4H3,(H,17,19)/t12-,14-/m1/s1