5-[(4-nitrophenyl)methoxycarbonylamino]-3-oxidanyl-hexanoic acid

Systemtic Name: 5-[(4-nitrophenyl)methoxycarbonylamino]-3-oxidanyl-hexanoic acid Openeye Name: 3-hydroxy-5-[(4-nitrophenyl)methoxycarbonylamino]hexanoic acid CAS Name: 3-hydroxy-5-[[(4-nitrophenyl)methoxy-oxomethyl]amino]hexanoic acid IUPAC Name: 3-hydroxy-5-[(4-nitrophenyl)methoxycarbonylamino]hexanoic acid Traditional Name: 3-hydroxy-5-[(4-nitrobenzyl)oxycarbonylamino]hexanoic acid Formula: C14H18N2O7 MolecularWeight: 326.30192

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(CC(=O)O)O)NC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(CC(CC(=O)O)O)NC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C14H18N2O7/c1-9(6-12(17)7-13(18)19)15-14(20)23-8-10-2-4-11(5-3-10)16(21)22/h2-5,9,12,17H,6-8H2,1H3,(H,15,20)(H,18,19)