5-[3-[4-[(E)-2-nitroethenyl]phenoxy]propoxy]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[3-[4-[(E)-2-nitroethenyl]phenoxy]propoxy]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[3-[4-[(E)-2-nitrovinyl]phenoxy]propoxy]-5-oxo-pentanoic acid CAS Name: 5-[3-[4-[(E)-2-nitroethenyl]phenoxy]propoxy]-5-oxopentanoic acid IUPAC Name: 5-[3-[4-[(E)-2-nitroethenyl]phenoxy]propoxy]-5-oxopentanoic acid Traditional Name: 5-keto-5-[3-[4-[(E)-2-nitrovinyl]phenoxy]propoxy]valeric acid Formula: C16H19NO7 MolecularWeight: 337.32456

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=C[N+](=O)[O-])OCCCOC(=O)CCCC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C16H19NO7/c18-15(19)3-1-4-16(20)24-12-2-11-23-14-7-5-13(6-8-14)9-10-17(21)22/h5-10H,1-4,11-12H2,(H,18,19)/b10-9+