3-[6-[methanoyl-[(2-methylpropan-2-yl)oxy]amino]hexanoylamino]-5-nitro-benzoic acid

Systemtic Name: 3-[6-[methanoyl-[(2-methylpropan-2-yl)oxy]amino]hexanoylamino]-5-nitro-benzoic acid Openeye Name: 3-[6-[tert-butoxy(formyl)amino]hexanoylamino]-5-nitro-benzoic acid CAS Name: 3-[[6-[formyl-[(2-methylpropan-2-yl)oxy]amino]-1-oxohexyl]amino]-5-nitrobenzoic acid IUPAC Name: 3-[6-[formyl-[(2-methylpropan-2-yl)oxy]amino]hexanoylamino]-5-nitrobenzoic acid Traditional Name: 3-[6-[tert-butoxy(formyl)amino]hexanoylamino]-5-nitro-benzoic acid Formula: C18H25N3O7 MolecularWeight: 395.407

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)ON(CCCCCC(=O)NC1=CC(=CC(=C1)C(=O)O)[N+](=O)[O-])C=O

Isomeric SMILES

CC(C)(C)ON(CCCCCC(=O)NC1=CC(=CC(=C1)C(=O)O)[N+](=O)[O-])C=O

InChI

InChI=1S/C18H25N3O7/c1-18(2,3)28-20(12-22)8-6-4-5-7-16(23)19-14-9-13(17(24)25)10-15(11-14)21(26)27/h9-12H,4-8H2,1-3H3,(H,19,23)(H,24,25)