2-chloranyl-5-[(5-nitro-2-piperidin-1-yl-phenyl)carbonylamino]benzoic acid

Systemtic Name: 2-chloranyl-5-[(5-nitro-2-piperidin-1-yl-phenyl)carbonylamino]benzoic acid Openeye Name: 2-chloro-5-[[5-nitro-2-(1-piperidyl)benzoyl]amino]benzoic acid CAS Name: 2-chloro-5-[[[5-nitro-2-(1-piperidinyl)phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 2-chloro-5-[(5-nitro-2-piperidin-1-ylbenzoyl)amino]benzoic acid Traditional Name: 2-chloro-5-[(5-nitro-2-piperidino-benzoyl)amino]benzoic acid Formula: C19H18ClN3O5 MolecularWeight: 403.81632

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC(=C(C=C3)Cl)C(=O)O

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC(=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C19H18ClN3O5/c20-16-6-4-12(10-14(16)19(25)26)21-18(24)15-11-13(23(27)28)5-7-17(15)22-8-2-1-3-9-22/h4-7,10-11H,1-3,8-9H2,(H,21,24)(H,25,26)