2-[4-(2-methylprop-2-enoxy)-3-nitro-phenyl]pentanoic acid

Systemtic Name: 2-[4-(2-methylprop-2-enoxy)-3-nitro-phenyl]pentanoic acid Openeye Name: 2-[4-(2-methylallyloxy)-3-nitro-phenyl]pentanoic acid CAS Name: 2-[4-(2-methylprop-2-enoxy)-3-nitrophenyl]pentanoic acid IUPAC Name: 2-[4-(2-methylprop-2-enoxy)-3-nitrophenyl]pentanoic acid Traditional Name: 2-[4-(2-methylallyloxy)-3-nitro-phenyl]valeric acid Formula: C15H19NO5 MolecularWeight: 293.31506

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC(=C(C=C1)OCC(=C)C)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CCCC(C1=CC(=C(C=C1)OCC(=C)C)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C15H19NO5/c1-4-5-12(15(17)18)11-6-7-14(21-9-10(2)3)13(8-11)16(19)20/h6-8,12H,2,4-5,9H2,1,3H3,(H,17,18)