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

Systemtic Name: [(1R)-1-(2-chlorophenyl)ethyl] 3-nitro-4-pyrrolidin-1-yl-benzoate Openeye Name: [(1R)-1-(2-chlorophenyl)ethyl] 3-nitro-4-pyrrolidin-1-yl-benzoate CAS Name: 3-nitro-4-(1-pyrrolidinyl)benzoic acid [(1R)-1-(2-chlorophenyl)ethyl] ester IUPAC Name: [(1R)-1-(2-chlorophenyl)ethyl] 3-nitro-4-pyrrolidin-1-ylbenzoate Traditional Name: 3-nitro-4-pyrrolidino-benzoic acid [(1R)-1-(2-chlorophenyl)ethyl] ester Formula: C19H19ClN2O4 MolecularWeight: 374.81816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Cl)OC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C1=CC=CC=C1Cl)OC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H19ClN2O4/c1-13(15-6-2-3-7-16(15)20)26-19(23)14-8-9-17(18(12-14)22(24)25)21-10-4-5-11-21/h2-3,6-9,12-13H,4-5,10-11H2,1H3/t13-/m1/s1