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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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