6-[(3,5-dinitro-4-piperidin-1-yl-phenyl)carbonylamino]hexanoic acid

Systemtic Name: 6-[(3,5-dinitro-4-piperidin-1-yl-phenyl)carbonylamino]hexanoic acid Openeye Name: 6-[[3,5-dinitro-4-(1-piperidyl)benzoyl]amino]hexanoic acid CAS Name: 6-[[[3,5-dinitro-4-(1-piperidinyl)phenyl]-oxomethyl]amino]hexanoic acid IUPAC Name: 6-[(3,5-dinitro-4-piperidin-1-ylbenzoyl)amino]hexanoic acid Traditional Name: 6-[(3,5-dinitro-4-piperidino-benzoyl)amino]hexanoic acid Formula: C18H24N4O7 MolecularWeight: 408.40576

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2[N+](=O)[O-])C(=O)NCCCCCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2[N+](=O)[O-])C(=O)NCCCCCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C18H24N4O7/c23-16(24)7-3-1-4-8-19-18(25)13-11-14(21(26)27)17(15(12-13)22(28)29)20-9-5-2-6-10-20/h11-12H,1-10H2,(H,19,25)(H,23,24)