2,4-bis(chloranyl)-5-[(3-nitro-4-piperidin-1-yl-phenyl)carbonylamino]benzoic acid

Systemtic Name: 2,4-bis(chloranyl)-5-[(3-nitro-4-piperidin-1-yl-phenyl)carbonylamino]benzoic acid Openeye Name: 2,4-dichloro-5-[[3-nitro-4-(1-piperidyl)benzoyl]amino]benzoic acid CAS Name: 2,4-dichloro-5-[[[3-nitro-4-(1-piperidinyl)phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 2,4-dichloro-5-[(3-nitro-4-piperidin-1-ylbenzoyl)amino]benzoic acid Traditional Name: 2,4-dichloro-5-[(3-nitro-4-piperidino-benzoyl)amino]benzoic acid Formula: C19H17Cl2N3O5 MolecularWeight: 438.26138

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17Cl2N3O5/c20-13-10-14(21)15(9-12(13)19(26)27)22-18(25)11-4-5-16(17(8-11)24(28)29)23-6-2-1-3-7-23/h4-5,8-10H,1-3,6-7H2,(H,22,25)(H,26,27)