tert-butyl-[5-[(3-methoxy-5-nitro-4-oxidanyl-phenyl)carbonylamino]hexyl]carbamic acid

Systemtic Name: tert-butyl-[5-[(3-methoxy-5-nitro-4-oxidanyl-phenyl)carbonylamino]hexyl]carbamic acid Openeye Name: tert-butyl-[5-[(4-hydroxy-3-methoxy-5-nitro-benzoyl)amino]hexyl]carbamic acid CAS Name: tert-butyl-[5-[[(4-hydroxy-3-methoxy-5-nitrophenyl)-oxomethyl]amino]hexyl]carbamic acid IUPAC Name: tert-butyl-[5-[(4-hydroxy-3-methoxy-5-nitrobenzoyl)amino]hexyl]carbamic acid Traditional Name: tert-butyl-[5-[(4-hydroxy-3-methoxy-5-nitro-benzoyl)amino]hexyl]carbamic acid Formula: C19H29N3O7 MolecularWeight: 411.44946

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCN(C(=O)O)C(C)(C)C)NC(=O)C1=CC(=C(C(=C1)OC)O)[N+](=O)[O-]

Isomeric SMILES

CC(CCCCN(C(=O)O)C(C)(C)C)NC(=O)C1=CC(=C(C(=C1)OC)O)[N+](=O)[O-]

InChI

InChI=1S/C19H29N3O7/c1-12(8-6-7-9-21(18(25)26)19(2,3)4)20-17(24)13-10-14(22(27)28)16(23)15(11-13)29-5/h10-12,23H,6-9H2,1-5H3,(H,20,24)(H,25,26)