4-chloranyl-3-[(5-nitro-2-pyrrolidin-1-yl-phenyl)carbonylamino]benzoate

Systemtic Name: 4-chloranyl-3-[(5-nitro-2-pyrrolidin-1-yl-phenyl)carbonylamino]benzoate Openeye Name: 4-chloro-3-[(5-nitro-2-pyrrolidin-1-yl-benzoyl)amino]benzoate CAS Name: 4-chloro-3-[[[5-nitro-2-(1-pyrrolidinyl)phenyl]-oxomethyl]amino]benzoate IUPAC Name: 4-chloro-3-[(5-nitro-2-pyrrolidin-1-ylbenzoyl)amino]benzoate Traditional Name: 4-chloro-3-[(5-nitro-2-pyrrolidino-benzoyl)amino]benzoate Formula: C18H15ClN3O5- MolecularWeight: 388.7818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=C(C=CC(=C3)C(=O)[O-])Cl

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=C(C=CC(=C3)C(=O)[O-])Cl

InChI

InChI=1S/C18H16ClN3O5/c19-14-5-3-11(18(24)25)9-15(14)20-17(23)13-10-12(22(26)27)4-6-16(13)21-7-1-2-8-21/h3-6,9-10H,1-2,7-8H2,(H,20,23)(H,24,25)/p-1