tert-butyl N-[(1R,2R)-1-(4-methylphenyl)-2-nitro-propyl]carbamate

Systemtic Name: tert-butyl N-[(1R,2R)-1-(4-methylphenyl)-2-nitro-propyl]carbamate Openeye Name: tert-butyl N-[(1R,2R)-2-nitro-1-(p-tolyl)propyl]carbamate CAS Name: N-[(1R,2R)-1-(4-methylphenyl)-2-nitropropyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(1R,2R)-1-(4-methylphenyl)-2-nitropropyl]carbamate Traditional Name: N-[(1R,2R)-2-nitro-1-(p-tolyl)propyl]carbamic acid tert-butyl ester Formula: C15H22N2O4 MolecularWeight: 294.34618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(C)[N+](=O)[O-])NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)[C@H]([C@@H](C)[N+](=O)[O-])NC(=O)OC(C)(C)C

InChI

InChI=1S/C15H22N2O4/c1-10-6-8-12(9-7-10)13(11(2)17(19)20)16-14(18)21-15(3,4)5/h6-9,11,13H,1-5H3,(H,16,18)/t11-,13+/m1/s1