6-(chloranylamino)-2-[2-methylpropyl-[(4-nitrophenyl)methyl]amino]hexanoic acid

Systemtic Name: 6-(chloranylamino)-2-[2-methylpropyl-[(4-nitrophenyl)methyl]amino]hexanoic acid Openeye Name: 6-(chloroamino)-2-[isobutyl-[(4-nitrophenyl)methyl]amino]hexanoic acid CAS Name: 6-(chloroamino)-2-[2-methylpropyl-[(4-nitrophenyl)methyl]amino]hexanoic acid IUPAC Name: 6-(chloroamino)-2-[2-methylpropyl-[(4-nitrophenyl)methyl]amino]hexanoic acid Traditional Name: 6-(chloroamino)-2-[isobutyl-(4-nitrobenzyl)amino]hexanoic acid Formula: C17H26ClN3O4 MolecularWeight: 371.85904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=CC=C(C=C1)[N+](=O)[O-])C(CCCCNCl)C(=O)O

Isomeric SMILES

CC(C)CN(CC1=CC=C(C=C1)[N+](=O)[O-])C(CCCCNCl)C(=O)O

InChI

InChI=1S/C17H26ClN3O4/c1-13(2)11-20(16(17(22)23)5-3-4-10-19-18)12-14-6-8-15(9-7-14)21(24)25/h6-9,13,16,19H,3-5,10-12H2,1-2H3,(H,22,23)