2-(3-chloranylphenoxy)ethyl 5-nitro-2-pyrrolidin-1-yl-benzoate

Systemtic Name: 2-(3-chloranylphenoxy)ethyl 5-nitro-2-pyrrolidin-1-yl-benzoate Openeye Name: 2-(3-chlorophenoxy)ethyl 5-nitro-2-pyrrolidin-1-yl-benzoate CAS Name: 5-nitro-2-(1-pyrrolidinyl)benzoic acid 2-(3-chlorophenoxy)ethyl ester IUPAC Name: 2-(3-chlorophenoxy)ethyl 5-nitro-2-pyrrolidin-1-ylbenzoate Traditional Name: 5-nitro-2-pyrrolidino-benzoic acid 2-(3-chlorophenoxy)ethyl ester Formula: C19H19ClN2O5 MolecularWeight: 390.81756

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OCCOC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OCCOC3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H19ClN2O5/c20-14-4-3-5-16(12-14)26-10-11-27-19(23)17-13-15(22(24)25)6-7-18(17)21-8-1-2-9-21/h3-7,12-13H,1-2,8-11H2