tert-butyl N-[(1S)-1-(4-chlorophenyl)-2-nitro-ethyl]carbamate

Systemtic Name: tert-butyl N-[(1S)-1-(4-chlorophenyl)-2-nitro-ethyl]carbamate Openeye Name: tert-butyl N-[(1S)-1-(4-chlorophenyl)-2-nitro-ethyl]carbamate CAS Name: N-[(1S)-1-(4-chlorophenyl)-2-nitroethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(1S)-1-(4-chlorophenyl)-2-nitroethyl]carbamate Traditional Name: N-[(1S)-1-(4-chlorophenyl)-2-nitro-ethyl]carbamic acid tert-butyl ester Formula: C13H17ClN2O4 MolecularWeight: 300.73808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17ClN2O4/c1-13(2,3)20-12(17)15-11(8-16(18)19)9-4-6-10(14)7-5-9/h4-7,11H,8H2,1-3H3,(H,15,17)/t11-/m1/s1