[(1R)-1-(2-chlorophenyl)ethyl] 3-methyl-4-nitro-benzoate

Systemtic Name: [(1R)-1-(2-chlorophenyl)ethyl] 3-methyl-4-nitro-benzoate Openeye Name: [(1R)-1-(2-chlorophenyl)ethyl] 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic acid [(1R)-1-(2-chlorophenyl)ethyl] ester IUPAC Name: [(1R)-1-(2-chlorophenyl)ethyl] 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid [(1R)-1-(2-chlorophenyl)ethyl] ester Formula: C16H14ClNO4 MolecularWeight: 319.73966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC(C)C2=CC=CC=C2Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O[C@H](C)C2=CC=CC=C2Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H14ClNO4/c1-10-9-12(7-8-15(10)18(20)21)16(19)22-11(2)13-5-3-4-6-14(13)17/h3-9,11H,1-2H3/t11-/m1/s1